SCHEMBL25837396

SCHEMBL25837396

COc1cc2c(OCc3ccccc3)cc(C(=O)O)c(-c3ccc(-c4ccc(C(F)(F)F)cc4)cc3)c2cc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.49
PTPN2 P17706 2/20 0.49
PTPN6 P29350 2/20 0.49
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
RXRG P48443 1/20 0.47
CTSV O60911 3/20 0.46
CTSL P07711 3/20 0.46
PSEN1 P49768 3/20 0.44
PSEN2 P49810 1/20 0.44
APH1B Q8WW43 1/20 0.44
NCSTN Q92542 1/20 0.44
APH1A Q96BI3 1/20 0.44
PSENEN Q9NZ42 1/20 0.44
DHODH Q02127 1/20 0.44
ALOX5 P09917 1/20 0.44
PPARD Q03181 3/20 0.43
PTGER1 P34995 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.42
MGLL Q99685 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
SCHEMBL22148986 0.99 PTPN1 (0.48) PTPN1PTPN2PTPN6RXRARXRB
SCHEMBL22149137 0.91 PTPN1 (0.46) PTPN1PTPN2PTPN6RXRARXRB
SCHEMBL25876720 0.89 PTPN1 (0.47) PTPN1PTPN2PTPN6RXRARXRB
SCHEMBL25837383 0.85 CTSV (0.48) RXRACTSVCTSLMRGPRX4
SCHEMBL25837411 0.85 PTPN1 (0.45) PTPN1PTPN2PTPN6RXRARXRB
SCHEMBL25837414 0.84 PTPN1 (0.44) PTPN1PTPN2PTPN6RXRARXRB
SCHEMBL22149016 0.84 PTPN1 (0.43) PTPN1PTPN2PTPN6RXRARXRB
SCHEMBL25837469 0.81 CTSV (0.46) RXRACTSVCTSLMRGPRX4
SCHEMBL22149090 0.81 MGLL (0.47) PTPN1PTPN2PTPN6RXRARXRB
SCHEMBL15763615 0.80 MGAM (0.44) CTSVCTSLDHODHPTGER1MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023136213-A1 PHOTOCHROMIC COMPOUND, NAPHTHOL DERIVATIVE, CURABLE COMPOSITION, OPTICAL ARTICLE, LENS, AND EYEGLASSES 株式会社トクヤマ 2023-07-20 WO disclosed