SCHEMBL11474148

SCHEMBL11474148

C=CCN(C(=O)Cc1ccccc1)c1nnn(C)n1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ TRPM8 Q7Z2W7 1/20 0.39
▸ TSHR P16473 1/20 0.38
▸ RAB9A P51151 2/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ CCR5 P51681 1/20 0.35
▸ NPC1 O15118 1/20 0.34

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
SCHEMBL11489499 0.77 POLB (0.35) POLBSMN1; SMN2TSHRRAB9A
SCHEMBL11475616 0.71 MLYCD (0.44) POLBALDH1A1GAAMEN1KMT2A
SCHEMBL14415481 0.70 NPC1 (0.51) SMN1; SMN2MEN1KMT2ATRPM8RAB9A
SCHEMBL11474569 0.68 TRPM8 (0.44) POLBALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL11508197 0.68 TRPM8 (0.41) POLBALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL10625983 0.68 SMN1; SMN2 (0.50) SMN1; SMN2TRPM8RAB9ANPC1
SCHEMBL11475533 0.68 SMN1; SMN2 (0.54) POLBALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL4851994 0.62 TACR1 (0.37) POLBALDH1A1GAAMEN1KMT2A
SCHEMBL15017515 0.62 DAGLA (0.48) POLBALDH1A1GAAMEN1KMT2A
SCHEMBL4207496 0.61 TSHR (0.51) POLBALDH1A1GAASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4186204-A ANTI-ALLERGIC ACTIVITY ELI LILLY AND COMPANY (GB) 1980-01-29 — — US claimed
US-4186204-A ANTI-ALLERGIC ACTIVITY ELI LILLY AND COMPANY (GB) 1980-01-29 — — US disclosed
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