SCHEMBL7346200

SCHEMBL7346200

CN1C2CCC1CC(OC(=O)N1C(=O)C(C)(C)c3ccccc31)C2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
HSD17B10 Q99714 1/20 0.50
HTR3E A5X5Y0 1/20 0.50
HTR3B O95264 1/20 0.50
CHRNA7 P36544 1/20 0.50
HTR3A P46098 1/20 0.50
HTR3D Q70Z44 1/20 0.50
HTR3C Q8WXA8 1/20 0.50
ALOX15 P16050 1/20 0.50
CHRM2 P08172 4/20 0.49
CHRM5 P08912 4/20 0.49
CHRM1 P11229 4/20 0.49
CHRM3 P20309 4/20 0.49
CHRM4 P08173 3/20 0.49
BLM P54132 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
HTR2C P28335 2/20 0.47

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
SCHEMBL7346340 0.79 TMEM97 (0.48) HTR3A
SCHEMBL7346437 0.75 HTR3E (0.44) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL7346433 0.75 HTR3E (0.44) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL10913532 0.74 ALOX15 (0.55) LMNACYP2D6CYP2C9HSD17B10HTR3E
SCHEMBL7347059 0.71 CHRM2 (0.38) CHRM2CHRM1CHRM3CHRM4SMN1; SMN2
SCHEMBL10917860 0.71 ALOX15 (0.52) LMNACYP2D6CYP2C9HSD17B10HTR3E
SCHEMBL7386968 0.71 HTR3E (0.55) LMNACYP2D6CYP2C9HSD17B10HTR3E
SCHEMBL21912571 0.71 BCHE (0.52) LMNAHSD17B10MEN1KMT2AALDH1A1
SCHEMBL9602046 0.70 ALOX15 (0.58) LMNACYP2D6CYP2C9HSD17B10HTR3E
SCHEMBL25180710 0.69 HSD17B10 (0.45) LMNAHSD17B10KDM4EMEN1KMT2A

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-5399562-A 5-hydroxytryptamine agonists or antagonists; gastrointestinal disorders G. D. SEARLE & CO. (US) 1995-03-21 US disclosed