SCHEMBL2531606

SCHEMBL2531606

CCCCC(CC)COC(=O)C(=Cc1ccc(OC)cc1)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.65
ALDH1A1 P00352 5/20 0.50
CYP3A4 P08684 3/20 0.50
CA2 P00918 1/20 0.50
LMNA P02545 4/20 0.47
MAPK1 P28482 3/20 0.47
TSHR P16473 3/20 0.46
PRSS1 P07477 1/20 0.45
PRSS2 P07478 1/20 0.45
PRSS3 P35030 1/20 0.45
TAS1R3 Q7RTX0 2/20 0.45
TAS1R1 Q7RTX1 2/20 0.45
HSD17B10 Q99714 1/20 0.43
ATM Q13315 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NR1H4 Q96RI1 1/20 0.40
CYP1A2 P05177 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL63068 0.95 TDP1 (0.67) TDP1ALDH1A1CYP3A4CA2LMNA
SCHEMBL8436026 0.92 TDP1 (0.64) TDP1ALDH1A1CYP3A4CA2LMNA
SCHEMBL8436027 0.92 TDP1 (0.64) TDP1ALDH1A1CYP3A4CA2LMNA
SCHEMBL20049917 0.91 TDP1 (0.62) TDP1ALDH1A1CYP3A4CA2LMNA
SCHEMBL18123566 0.90 TDP1 (0.61) TDP1ALDH1A1CYP3A4CA2LMNA
SCHEMBL17576317 0.90 TDP1 (0.61) TDP1ALDH1A1CYP3A4CA2LMNA
SCHEMBL13078900 0.90 TDP1 (0.61) TDP1ALDH1A1CYP3A4CA2LMNA
SCHEMBL29822393 0.90 TDP1 (0.52) TDP1ALDH1A1CYP3A4CA2LMNA
SCHEMBL21816547 0.89 TDP1 (0.60) TDP1ALDH1A1CYP3A4CA2LMNA
SCHEMBL20548409 0.85 ALDH1A1 (0.64) TDP1ALDH1A1CYP3A4CA2LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 114 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3030218-B2 GEL-LIKE SUN PROTECTION PRODUCT CONTAINING FATTY ALCOHOLS BEIERSDORF AG (DE) 2024-06-19 EP claimed
EP-3746183-A1 O/W EMULSION COMPRISING PHOTOCHEMICALLY STABLE 4-(TERT.-BUTYL)-4'-METHOXYDIBENZOYLMETHANE IN OIL DROPLETS SMALLER THAN 8 MICROMETERS Beiersdorf AG (DE) 2020-12-09 EP claimed
EP-3644952-A1 ACTIVE SUBSTANCE COMBINATIONS OF N-(4-AMINO-2-METHYL-QUINOLIN-6-YL)-2-((4-ETHYL-PHENOXY) METHYL) BENZAMIDE AND ONE OR MORE COSMETICALLY OR DERMATOLOGICALLY ACCEPTABLE UV-FILTER SUBSTANCES Beiersdorf AG (DE) 2020-05-06 EP claimed
WO-2019149565-A1 O/W EMULSION COMPRISING PHOTOCHEMICALLY STABLE 4-(TERT.-BUTYL)-4'-METHOXYDIBENZOYLMETHANE IN OIL DROPLETS SMALLER THAN 8 MICROMETERS BEIERSDORF AG (DE) 2019-08-08 WO claimed
CN-113164796-B Cosmetic composition comprising a specific hyperbranched copolymer and an anionic emulsifier 帝斯曼知识产权资产管理有限公司 2024-06-21 CN disclosed
CN-111867553-B Surface composition 帝斯曼知识产权资产管理有限公司 2024-06-07 CN disclosed
WO-2024042024-A1 HAIR CARE COMPOSITIONS LEADING TO AN INCREASE OF THE COLOUR RESISTANCE OF DYED HAIR DSM IP ASSETS B.V. (NL) 2024-02-29 WO disclosed
US-20240058248-A1 IMPROVE THE WATER RESISTANCE OF COSMETIC COMPOSITIONS COMPRISING BISOCTRIZOLE DSM IP ASSETS B.V. (NL) 2024-02-22 US disclosed
US-20240041735-A1 INCREASED SOLUBILIZATION OF ISCOTRIZINOL TOTALENERGIES ONETECH (FR) 2024-02-08 US disclosed
US-20240041724-A1 REDUCTION OF STICKINESS OF COSMETIC COMPOSITIONS COMPRISING BISOCTRIZOLE DSM IP ASSETS B.V. (NL) 2024-02-08 US disclosed
US-20240041723-A1 REDUCTION OF STICKINESS OF COSMETIC COMPOSITIONS COMPRISING OCTOCRYLENE DSM IP ASSETS B.V. (NL) 2024-02-08 US disclosed
US-20240041732-A1 INCREASED SOLUBILIZATION OF DIETHYLAMINO HYDROXYBENZOYL HEXYL BENZOATE TOTALENERGIES ONETECH (FR) 2024-02-08 US disclosed
WO-2003030856-A1 SILOXANE SUNSCREEN COMPOSITIONS ROCHE VITAMINS AG (CH) 2003-04-17 WO disclosed
US-6440399-B1 SKIN PROTECTION FROM UV LIGHT, MICROORGANISMS, CHEMICALS; HYDROPHILIC, LIPOPHILIC MICRONIZED INORGANIC PIGMENT PARTI-CLES; METAL OXIDES COATED WITH DIMETHYLPOLYSILOXANE, SILICA GEL, ALUMINIUM HYDROXIDE, ALUMINA AND/OR SILICON DIOXIDE BEIERSDORF AG (DE) 2002-08-27 US disclosed
US-20020077372-A1 PROCESS FOR THE PREPARATION OF O/W OR O/W/O EMULSIONS AND 0/W AND O/W/O EMULSIONS OBTAINABLE BY SUCH PROCESSES BEIERSDORF AKTIENGESELLSCHAFT (DE) 2002-06-20 US disclosed
WO-2001055262-A1 NEW PIGMENTS AND COMPOSITIONS CONTAINING THEM GHISALBERTI CARLO (BR) 2001-08-02 WO disclosed
US-5833951-A OILS, FATS AND/OR WAXES, THICKENERS AND ADDITIVES BEIERSDORF AG (DE) 1998-11-10 US disclosed
US-5780042-A MIXTURE OF 2,4-O-FURFURYLIDENESORBITOL AND/OR ITS ALKYL ETHERS WITH ANTIOXIDANTS BEIERSDORF AG (DE) 1998-07-14 US disclosed
US-5710177-A Synergistic combinations of active substance for the cosmetic or dermatological care of the skin, hair & nails BEIERSDORF AG (DE) 1998-01-20 US disclosed
US-5620680-A CONTAINS ATLEAST ONE ULTRAVIOLET RADIATION SCREENING AGENT SELECTED FROM 3-BEZYLIDENECAMPHORS, 4-AMINOBENZOIC ACIDS, ESTERS OF CINNAMIC AND SALICYLIC ACIDS, BENZOPHENONES, TRIAZINES, AND DIONES; OXIDATION RESISTANCE BEIERSDORF AKTIENGESELLSCHAFT (DE) 1997-04-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240041732-A1 INCREASED SOLUBILIZATION OF DIETHYLAMINO HYDROXYBENZOYL HEXYL BENZOATE CDC73, CYP51A1, BCAS2 TDP1 1325/4885ALDH1A1 1350/4885CYP3A4 988/4885
US-20240058248-A1 IMPROVE THE WATER RESISTANCE OF COSMETIC COMPOSITIONS COMPRISING BISOCTRIZOLE PARG, FHIT, MMS19 TDP1 1908/4885ALDH1A1 3545/4885CYP3A4 629/4885
US-20240041723-A1 REDUCTION OF STICKINESS OF COSMETIC COMPOSITIONS COMPRISING OCTOCRYLENE CUTA, C9, TYR TDP1 2081/4885ALDH1A1 1887/4885CYP3A4 3507/4885
US-20240041735-A1 INCREASED SOLUBILIZATION OF ISCOTRIZINOL CYP51A1, SCD5, SI TDP1 2289/4885ALDH1A1 907/4885CYP3A4 449/4885
US-20240041724-A1 REDUCTION OF STICKINESS OF COSMETIC COMPOSITIONS COMPRISING BISOCTRIZOLE CUTA, FHIT, C9 TDP1 2387/4885ALDH1A1 2668/4885CYP3A4 610/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.