Homosalate

Homosalate

SCHEMBL3634890

CC1CC(OC(=O)c2ccccc2O)CC(C)(C)C1.CC1CC(OC(=O)c2ccccc2O)CC(C)(C)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 1.00
LMNA P02545 3/20 1.00
CYP3A4 P08684 3/20 1.00
CYP2C9 P11712 3/20 1.00
CYP2C19 P33261 2/20 1.00
CYP1A2 P05177 1/20 1.00
NR1I2 O75469 1/20 0.57
ABCB11 O95342 1/20 0.57
TSHR P16473 4/20 0.45
BCHE P06276 3/20 0.41
HSD17B10 Q99714 4/20 0.40
KDM4E B2RXH2 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
ALOX12 P18054 1/20 0.40
HTT P42858 1/20 0.40
ATM Q13315 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GAA P10253 1/20 0.40

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
Homosalate SCHEMBL16207 1.00 ALDH1A1 (1.00) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
Homosalate SCHEMBL29356436 1.00 ALDH1A1 (1.00) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
Homosalate SCHEMBL2808104 0.99 ALDH1A1 (0.97) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
Homosalate SCHEMBL9452512 0.93 LMNA (0.86) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
Homosalate SCHEMBL8840156 0.93 ALDH1A1 (0.86) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
Homosalate SCHEMBL9452507 0.93 LMNA (0.86) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
Homosalate SCHEMBL9099946 0.93 ALDH1A1 (0.86) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
Homosalate SCHEMBL8106557 0.93 LMNA (0.86) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
Homosalate SCHEMBL2016281 0.93 LMNA (0.86) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
Homosalate SCHEMBL8863191 0.92 LMNA (0.84) ALDH1A1LMNACYP3A4CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9060943-B2 Compositions comprising trans-tert-butyl cyclohexanol as skin irritation-reducing agent SYMRISE AG (DE) 2015-06-23 US disclosed
WO-2014149486-A1 POLYMERS POLYMERIZED FROM AT LEAST FOUR MONOMERS, AND COMPOSITIONS AND USES THEREOF ISP INVESTMENTS INC. (US) 2014-09-25 WO disclosed
EP-2701670-A1 CLEAR WET SPRAYS AND GELS Isp Investments Inc. (US) 2014-03-05 EP disclosed
EP-2649033-A2 COMPOSITIONS AND METHODS FOR STABILIZING INGREDIENTS USING 2,4-PENTANEDIONE COMPOUNDS Sytheon Ltd. (US) 2013-10-16 EP disclosed
WO-2012149355-A1 CLEAR WET SPRAYS AND GELS ISP INVESTMENTS INC. (US) 2012-11-01 WO disclosed
WO-2012078546-A2 COMPOSITIONS AND METHODS FOR STABILIZING INGREDIENTS USING 2,4-PENTANEDIONE COMPOUNDS SYTHEON LTD. (US) 2012-06-14 WO disclosed
US-20120121737-A1 COMPOSITIONS COMPRISING TRANS-TERT-BUTYL CYCLOHEXANOL AS SKIN IRRITATION-REDUCING AGENT SYMRISE AG (DE) 2012-05-17 US disclosed
EP-2144590-A1 SKIN TREATMENT COMPOSITIONS AND METHODS Sytheon Ltd. (US) 2010-01-20 EP disclosed
WO-2008140673-A1 SKIN TREATMENT COMPOSITIONS AND METHODS SYTHEON LTD. (US) 2008-11-20 WO disclosed
EP-1811989-A1 PREPARATION CONTAINING OXIDIZED FLAVONOID DERIVATIVES Merck Patent GmbH (DE) 2007-08-01 EP disclosed
US-6146617-A A SUNSCREEN, SKIN CREAM OR GEL, HAIR GEL OR COSMETIC COMPOSITION MIXTURE COMPRISING A MICRONIZED METAL OXIDE, AND A LIQUID UV FILTER INCLUDING BENTONE, AEROSIL AND/OR ETHYLCELLULOSE MERCK PATENT GESELLSCHAFT MIT (DE) 2000-11-14 US disclosed
US-6143906-A REACTING ASCORBIC ACID OR ASCORBIC ACID DERIVATIVES WITH SORBIC ACID OR SORBIC ACID DERIVATIVE TO FORM ASCORBYL SORBATES WHICH IS USED AS COSMETIC OR DURG BASF AKTIENGESELLSCHAFT (DE) 2000-11-07 US disclosed
US-6090374-A TREATING THE SKIN OR HAIR WITH EFFECTIVE AMOUNT OF ALPHA-STYRENE COMPOUND FOR PROTECTING THE HUMAN SKIN OR HAIR FROM ULTRAVIOLET RADIATION BASF AKTIENGESELLSCHAFT (DE) 2000-07-18 US disclosed
US-6069258-A SUNSCREEN AGENTS; PROTECTIVE COATINGS FOR SKIN BASF AKTIENGESELLSCHAFT (DE) 2000-05-30 US disclosed
US-6007828-A SUNSCREEN AGENT MIXTURE CONTAINING 1,1-DINITRILO-2,2-DIPHENYL ETHYLENE DERIVATIVE IN A COSMETIC CARRIER BASF AKTIENGESELLSCHAFT (DE) 1999-12-28 US disclosed
US-5968484-A APPLYING 2-ORGANOCARBONYLACRYLONITRILE DERIVATIVE AS SUNSCREEN AGENT BASF AKTIENGESELLSCHAFT (DE) 1999-10-19 US disclosed
EP-0814760-A1 SUBSTITUTED o-AMINOCARBONYLBENZOIC ACID SALTS AND THEIR USE AS SUNSCREENS STEPAN COMPANY (US) 1998-01-07 EP disclosed
US-5705169-A REACTING FORMYLBENZALDEHYDE WITH KETOTRICYCLODECANE; DRUGS, COSMETICS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-01-06 US disclosed
WO-1997025971-A1 SUBSTITUTED o-AMINOCARBONYLBENZOIC ACID SALTS AND THEIR USE AS SUNSCREENS STEPAN COMPANY (US) 1997-07-24 WO disclosed
US-5399563-A Sunscreen agents MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-03-21 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 (1 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-20120121737-A1 COMPOSITIONS COMPRISING TRANS-TERT-BUTYL CYCLOHEXANOL AS SKIN IRRITATION-REDUCING AGENT TERT, CUTA, TRPA1 ALDH1A1 1800/4885LMNA 1450/4885CYP3A4 345/4885

“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.