SCHEMBL3149374

SCHEMBL3149374

Cc1ccc(C)c(OCc2ccc(CCl)cc2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
HPGD P15428 1/20 0.47
TSHR P16473 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
FFAR1 O14842 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
CYP2C9 P11712 2/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
MAPT P10636 2/20 0.43
TDP1 Q9NUW8 3/20 0.40
TTR P02766 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C8 P10632 1/20 0.40
CHRM1 P11229 1/20 0.40
ADRA1A P35348 1/20 0.40
PPARG P37231 1/20 0.40
HTR2B P41595 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
SCHEMBL14228414 0.82 MAPT (0.56) ALDH1A1HPGDTSHRSMN1; SMN2NPC1
SCHEMBL28117285 0.81 MAPT (0.51) SMN1; SMN2FFAR1FFAR4LMNAHTT
SCHEMBL15872037 0.81 GAA (0.60) ALDH1A1HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL27834056 0.81 ALDH1A1 (0.48) ALDH1A1HPGDTSHRSMN1; SMN2NPC1
SCHEMBL9946053 0.80 ALDH1A1 (0.46) ALDH1A1HPGDTSHRSMN1; SMN2NPC1
SCHEMBL15872010 0.80 MAOB (0.47) ALDH1A1HPGDTSHRSMN1; SMN2NPC1
SCHEMBL10737281 0.79 TTR (0.44) ALDH1A1TSHRCYP2C9LMNAHTT
SCHEMBL1200245 0.79 MAOA (0.52) ALDH1A1HPGDTSHRSMN1; SMN2RAB9A
SCHEMBL2558238 0.79 ALDH1A1 (0.48) ALDH1A1HPGDTSHRSMN1; SMN2NPC1
SCHEMBL8624168 0.79 RXRA (0.61) ALDH1A1HPGDNPC1RAB9AFFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2154123-B1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL CO (JP) 2013-10-23 EP disclosed
CN-101679171-B Method for producing benzaldehyde compound SUMITOMO CHEMICAL CO 2012-12-12 CN disclosed
US-7851659-B2 Method for producing benzaldehyde compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-12-14 US disclosed
US-20100234645-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-16 US disclosed
CN-101679171-A Method for producing benzaldehyde compound SUMITOMO CHEMICAL CO 2010-03-24 CN disclosed
EP-2154123-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND Sumitomo Chemical Company, Limited (JP) 2010-02-17 EP 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-20100234645-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND NQO1, NQO2, NDUFC2 ALDH1A1 94/4885HPGD 564/4885TSHR 2696/4885

“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.