SCHEMBL7490294

SCHEMBL7490294

OC1CC2CC(N3CCNCC3)CC2C1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.36
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL3827331 0.89 HTR6 (0.40) HTR6HPGDKMT2ASMN1; SMN2
SCHEMBL3827330 0.89 HTR6 (0.40) HTR6HPGDKMT2ASMN1; SMN2
SCHEMBL21920952 0.89 HTR6 (0.40) HTR6HPGDKMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL21852645 0.86 HPGD (0.39) HTR6HPGDKMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL20595109 0.86 HPGD (0.39) HTR6HPGDKMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL21852697 0.86 HPGD (0.39) HTR6HPGDKMT2ASMN1; SMN2
SCHEMBL24379445 0.74 LMNA (0.43) HTR6HPGDKMT2ASMN1; SMN2
SCHEMBL22692239 0.74 LMNA (0.43) HTR6HPGDKMT2ASMN1; SMN2
SCHEMBL7897450 0.73 HPGD (0.47) HTR6HPGDKMT2ASMN1; SMN2
SCHEMBL22834986 0.73 HPGD (0.47) HTR6HPGDKMT2ASMN1; SMN2

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
EP-0882044-B1 1,4-DIHYDROPYRIDINE COMPOUNDS AS BRADYKININ ANTAGONISTS PFIZER (US) 2002-07-17 EP disclosed
US-6131226-A 2-SUBSTITUTED,3,5-BIS(METHOXYCARBONYL),4-(2,6-DIHALOPHENYL), 6-(1-((SUBSTITUTED)RING)PIPERAZIN-1,4-YLENE-CARBONYLMETHYL)-1, 4-DIHYDROPYRIDINES; FOR TREATING INFLAMMATION, PAIN, VIRAL INFECTIONS, CARDIOVASCULAR DISEASE, ALLERGIES, ASTHMA PFIZER INC. (US) 2000-10-17 US disclosed