SCHEMBL2494547

SCHEMBL2494547

CCCc1ccc(-c2ccc(C)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.52
CYP2A6 P11509 1/20 0.52
TAAR1 Q96RJ0 1/20 0.52
LPL P06858 1/20 0.46
LIPG Q9Y5X9 1/20 0.46
MCL1 Q07820 1/20 0.46
CNR2 P34972 1/20 0.45
HRH3 Q9Y5N1 2/20 0.44
NISCH Q9Y2I1 1/20 0.44
IDO1 P14902 1/20 0.44
CA2 P00918 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MAPT P10636 1/20 0.43
GFER P55789 1/20 0.43
RARB P10826 1/20 0.42
KCNH2 Q12809 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL9664329 0.98 CYP1A2 (0.50) CYP1A2CYP2A6TAAR1LPLLIPG
SCHEMBL326914 0.92 CYP1A2 (0.59) CYP1A2CYP2A6TAAR1LPLLIPG
SCHEMBL5493944 0.92 CYP1A2 (0.59) CYP1A2CYP2A6TAAR1LPLLIPG
SCHEMBL28572624 0.90 CYP1A2 (0.56) CYP1A2CYP2A6TAAR1LPLLIPG
SCHEMBL27348511 0.90 CYP1A2 (0.56) CYP1A2CYP2A6TAAR1LPLLIPG
Hydrochloric Acid SCHEMBL7988640 0.90 CYP1A2 (0.56) CYP1A2CYP2A6TAAR1LPLLIPG
SCHEMBL28182287 0.90 CYP1A2 (0.56) CYP1A2CYP2A6TAAR1LPLLIPG
SCHEMBL6546987 0.90 CYP1A2 (0.56) CYP1A2CYP2A6TAAR1LPLLIPG
SCHEMBL30057561 0.90 CYP1A2 (0.56) CYP1A2CYP2A6TAAR1LPLLIPG
Hydrogen Sulfide SCHEMBL28268146 0.90 CYP1A2 (0.56) CYP1A2CYP2A6TAAR1LPLLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117209342-A Synthesis method of para-substituted biphenyl compounds 浙江大学 2023-12-12 CN disclosed
EP-2380567-B1 MELANIN PRODUCTION INHIBITOR POLA CHEM IND INC (JP) 2019-01-16 EP disclosed
EP-3009123-A1 MELANIN PRODUCTION INHIBITOR Pola Chemical Industries Inc. (JP) 2016-04-20 EP disclosed
US-20150328107-A1 MELANIN PRODUCTION INHIBITOR POLA CHEMICAL INDUSTRIES INC. (JP) 2015-11-19 US disclosed
EP-2845587-A2 Melanin production inhibitor Pola Chemical Industries Inc. (JP) 2015-03-11 EP disclosed
US-20140363389-A1 MELANIN PRODUCTION INHIBITOR POLA CHEMICAL INDUSTRIES INC. (JP) 2014-12-11 US disclosed
US-8846012-B2 Melanin production inhibitor POLA CHEMICAL INDUSTRIES INC. (JP) 2014-09-30 US disclosed
EP-2380567-A1 MELANIN PRODUCTION INHIBITOR Pola Chemical Industries Inc. (JP) 2011-10-26 EP disclosed
US-20110243865-A1 MELANIN PRODUCTION INHIBITOR POLA CHEMICAL INDUSTRIES INC. (JP) 2011-10-06 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 (3 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-20110243865-A1 MELANIN PRODUCTION INHIBITOR TYR, F12, TH CYP1A2 28/4885CYP2A6 251/4885TAAR1 225/4885
US-20150328107-A1 MELANIN PRODUCTION INHIBITOR TYR, MC1R, F12 CYP1A2 28/4885CYP2A6 207/4885TAAR1 194/4885
US-20140363389-A1 MELANIN PRODUCTION INHIBITOR TYR, F12, MC1R CYP1A2 27/4885CYP2A6 241/4885TAAR1 225/4885

“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.