SCHEMBL9154608

SCHEMBL9154608

C[CH]CCCc1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 2/20 0.47
▸ BCL2L1 Q07817 1/20 0.46
▸ IGF1R P08069 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ AOC3 Q16853 1/20 0.44
▸ KCNH2 Q12809 6/20 0.43
▸ HTR3E A5X5Y0 1/20 0.42
▸ HTR3B O95264 1/20 0.42
▸ HTR3A P46098 1/20 0.42
▸ HTR3D Q70Z44 1/20 0.42
▸ HTR3C Q8WXA8 1/20 0.42
▸ HDAC3 O15379 1/20 0.42
▸ HDAC4 P56524 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC7 Q8WUI4 1/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ HDAC10 Q969S8 1/20 0.42
▸ HDAC11 Q96DB2 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ HDAC6 Q9UBN7 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
SCHEMBL432651 0.86 TAAR1 (0.50) TAAR1BCL2L1IGF1RALOX15AOC3
SCHEMBL11639779 0.80 CYP1A2 (0.48) TAAR1IGF1RALOX15KCNH2IDO1
SCHEMBL9150299 0.79 KCNH2 (0.45) TAAR1BCL2L1IGF1RALOX15AOC3
SCHEMBL14046070 0.79 MAOB (0.47) TAAR1BCL2L1IGF1RALOX15AOC3
SCHEMBL11336831 0.78 TAAR1 (0.47) TAAR1AOC3MAOBIDO1
SCHEMBL11515888 0.78 TAAR1 (0.46) TAAR1BCL2L1IGF1RALOX15AOC3
SCHEMBL3245743 0.78 TAAR1 (0.46) TAAR1BCL2L1IGF1RALOX15KCNH2
SCHEMBL22437591 0.78 HRH3 (0.42) TAAR1
SCHEMBL9150568 0.78 ESR1 (0.55) TAAR1IGF1RALOX15HTR3A
SCHEMBL8076093 0.78 TAAR1 (0.46) TAAR1BCL2L1IGF1RALOX15AOC3

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-5393774-A Antispasmodic agents PIEPER HELMUT (DE) 1995-02-28 — — US disclosed
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