SCHEMBL7368122

SCHEMBL7368122

CN1CC2CC1CC2N(C)C(=O)c1n[nH]c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 5/20 0.45
▸ HTR3A P46098 2/20 0.45
▸ YTHDC1 Q96MU7 1/20 0.44
▸ FLT3 P36888 4/20 0.43
▸ CNR1 P21554 1/20 0.42
▸ CNR2 P34972 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ STAT3 P40763 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ USP30 Q70CQ3 1/20 0.40
▸ CCNA2 P20248 1/20 0.40
▸ CDK2 P24941 1/20 0.40
▸ CCNA1 P78396 1/20 0.40
▸ EPHB3 P54753 1/20 0.40
▸ DYRK1A Q13627 1/20 0.39

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
SCHEMBL2089327 0.78 CHRNA7 (0.64) CHRNA7HTR3AYTHDC1FLT3CNR1
SCHEMBL2087087 0.76 DYRK1A (0.48) CHRNA7HTR3AYTHDC1FLT3NPC1
SCHEMBL7368125 0.75 SMN1; SMN2 (0.51) CHRNA7HTR3AYTHDC1CNR1CNR2
SCHEMBL3695594 0.75 DYRK1A (0.46) CHRNA7HTR3AYTHDC1FLT3NPC1
Hydrochloric Acid SCHEMBL6411553 0.74 DYRK1A (0.46) CHRNA7HTR3AYTHDC1FLT3NPC1
SCHEMBL12441910 0.72 CHRNA7 (0.64) CHRNA7HTR3AYTHDC1FLT3CNR1
SCHEMBL2086156 0.72 CHRNA7 (0.64) CHRNA7HTR3AYTHDC1FLT3CNR1
SCHEMBL1176568 0.71 YTHDC1 (0.49) CHRNA7HTR3AYTHDC1FLT3CNR1
SCHEMBL2013744 0.71 KDM4E (0.46) CHRNA7HTR3AYTHDC1FLT3CNR1
SCHEMBL5038866 0.71 YTHDC1 (0.49) CHRNA7HTR3AYTHDC1FLT3CNR1

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
EP-0200444-A2 Azabicyclononyl-indazole-carboxamide having 5-HT antagonist activity BEECHAM GROUP PLC (GB) 1986-11-05 — — EP claimed
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