SCHEMBL11094095

SCHEMBL11094095

CSC1C(=O)Nc2c(Cl)ccc(Oc3ccccc3)c21

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 2/20 0.35
▸ NTRK1 P04629 2/20 0.33
▸ IGF1R P08069 2/20 0.33
▸ FGFR1 P11362 2/20 0.33
▸ NTRK2 Q16620 2/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ MMP14 P50281 2/20 0.32
▸ MMP13 P45452 1/20 0.32
▸ PNLIP P16233 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ DPP4 P27487 1/20 0.32
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ EZH2 Q15910 1/20 0.32
▸ CYP1A1 P04798 1/20 0.32
▸ CYP1B1 Q16678 1/20 0.32

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
SCHEMBL11093677 0.70 CACNB4 (0.36) CYP1A2CYP2C9CYP2C19MMP14MMP13
SCHEMBL11092601 0.68 MMP14 (0.37) CYP1A2CYP2C9CYP2C19MMP14MMP13
SCHEMBL117727 0.67 CACNB4 (0.40) CYP1A2CYP2C9CYP2C19
SCHEMBL11088266 0.67 AHR (0.49) FFAR1
SCHEMBL11091196 0.64 MAOA (0.47) NTRK1IGF1RFGFR1NTRK2MMP13
Ethane SCHEMBL27569819 0.61 DPP4 (0.58) CYP1A2CYP3A4CYP2C9CYP2C19DPP4
SCHEMBL3790160 0.61 DPP4 (0.62) CYP1A2CYP3A4CYP2C9CYP2C19DPP4
SCHEMBL11091290 0.60 MEN1 (0.38) CYP3A4CYP2C9CYP2C19
SCHEMBL304918 0.60 CYP1A2 (0.48) CYP1A2CYP3A4CYP2C9CYP2C19DPP4
SCHEMBL21295423 0.60 NTRK1 (0.61) NTRK1IGF1RFGFR1NTRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4472433-A Phenoxyphenyl acetic acids and their medicinal use FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-09-18 — — US disclosed
EP-0008226-B1 PHENYL-ALKANOIC ACID DERIVATIVES, THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-11-02 — — EP disclosed
EP-0008226-A2 Phenyl-alkanoic acid derivatives, the preparation thereof and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-02-20 — — EP disclosed
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