SCHEMBL6232310

SCHEMBL6232310

C=CCOc1cc(C)ccc1C(C)C

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
KDM4E B2RXH2 3/20 0.49
TDP1 Q9NUW8 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.46
ADRB2 P07550 2/20 0.46
NPBWR1 P48145 1/20 0.46
MCHR1 Q99705 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MAPT P10636 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
TSHR P16473 1/20 0.45
ATM Q13315 1/20 0.45
HSD17B10 Q99714 2/20 0.44
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
NOD2 Q9HC29 1/20 0.43

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
SCHEMBL20968201 0.83 GAA (0.44) ALDH1A1KDM4ETDP1ADRB2MEN1
SCHEMBL4210977 0.82 MAPT (0.51) ALDH1A1KDM4ETDP1SMN1; SMN2NPBWR1
SCHEMBL15253520 0.81 ALDH1A1 (0.51) ALDH1A1KDM4ETDP1SMN1; SMN2ADRB2
SCHEMBL22215851 0.80 KDM4E (0.46) ALDH1A1KDM4ETDP1MEN1KMT2A
SCHEMBL8246277 0.80 ALDH1A1 (0.55) ALDH1A1KDM4ETDP1SMN1; SMN2ADRB2
SCHEMBL7816047 0.79 HPGD (0.51) ALDH1A1TDP1SMN1; SMN2MAPTTSHR
SCHEMBL11135052 0.78 ALDH1A1 (0.60) ALDH1A1KDM4ETDP1SMN1; SMN2NPBWR1
SCHEMBL6481497 0.78 ALDH1A1 (0.57) ALDH1A1KDM4ETDP1SMN1; SMN2ADRB2
SCHEMBL11974252 0.77 ADRB2 (0.50) ALDH1A1KDM4EADRB2MEN1KMT2A
SCHEMBL25484230 0.77 ADRB2 (0.56) ALDH1A1KDM4ETDP1SMN1; SMN2ADRB2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230276797-A1 DISINFECTANT SYSTEM BANISH, MICHELE 2023-09-07 US disclosed
US-20230276797-A1 DISINFECTANT SYSTEM BANISH, MICHELE 2023-09-07 US disclosed
EP-1053744-B1 Substituted phenols as fragrance, flavor and antimicrobial compounds TAKASAGO PERFUMERY CO LTD (JP) 2005-04-27 EP disclosed
EP-1053744-A2 Substituted phenols as fragrance, flavor and antimicrobial compounds Takasago International Corporation (JP) 2000-11-22 EP disclosed
US-6110888-A PHENOL SUBSTITUTED WITH ONE OF: PROPYL OR PROPENYL; ONE OF: HYDROGEN OR ALKYL; AND ONE TO THREE C3-C5 ALKYL GROUPS; FRAGRANCE AND ANTIMICROBIAL PROPERTIES; USE SUCH AS IN MOUTHWASHES TAKASAGO INTERNATIONAL CORPORATION (JP) 2000-08-29 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-20230276797-A1 DISINFECTANT SYSTEM FPR1, FPR2, FPR3 ALDH1A1 3634/4885KDM4E 4229/4885TDP1 974/4885

“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.