SCHEMBL7415226

SCHEMBL7415226

O=C(O[C@]1(C(=O)c2ccccc2)C(=O)OC(=O)[C@H]1O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ PPM1B O75688 1/20 0.36
▸ TSHR P16473 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ KMT2A Q03164 5/20 0.34
▸ MAPT P10636 2/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ MAOA P21397 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ BCHE P06276 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ STAT3 P40763 1/20 0.33

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
SCHEMBL7410693 1.00 F2 (0.37) F2LMNAPPM1BTSHRGAA
SCHEMBL1751899 1.00 F2 (0.37) F2LMNAPPM1BTSHRGAA
SCHEMBL15903870 0.86 TDP1 (0.39) GAAKMT2AMAPTSMN1; SMN2RAB9A
SCHEMBL5692181 0.76 PKM (0.35) LMNAMAPTNPC1RAB9ACYP2C9
SCHEMBL30686187 0.71 LMNA (0.38) LMNATSHRGAAKMT2AMAPT
SCHEMBL10392788 0.66 LMNA (0.44) F2LMNATSHRGAAKMT2A
SCHEMBL636837 0.63 LMNA (0.48) F2LMNAPPM1BTSHRGAA
SCHEMBL1751897 0.63 LMNA (0.48) F2LMNAPPM1BTSHRGAA
SCHEMBL637664 0.63 LMNA (0.48) F2LMNAPPM1BTSHRGAA
SCHEMBL30526381 0.63 F2 (0.48) F2LMNATSHRGAAKMT2A

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
US-5198449-A N-substituted alpha-arylazacycloalkylmethanamines and their use as cardiovascular agents A. H. ROBINS COMPANY INCORPORATED (US) 1993-03-30 — — US disclosed
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