SCHEMBL20909692

SCHEMBL20909692

Cc1ccc2c(c1)CCC(N1CC1)C2

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
GRIN2B Q13224 3/20 0.46
SRD5A1 P18405 1/20 0.44
FAAH O00519 1/20 0.44
TSHR P16473 1/20 0.44
ALDH1A1 P00352 2/20 0.41
OPRM1 P35372 2/20 0.40
OPRK1 P41145 2/20 0.40
OPRL1 P41146 2/20 0.40
OPRD1 P41143 1/20 0.39
HTR1D P28221 2/20 0.38
CYP3A4 P08684 1/20 0.38
HTR2A P28223 5/20 0.38
DRD2 P14416 2/20 0.38
HRH1 P35367 1/20 0.38
HTR2C P28335 3/20 0.38
HTR2B P41595 3/20 0.38

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
SCHEMBL13102476 0.93 LMNA (0.47) LMNAGRIN2BSRD5A1FAAHTSHR
SCHEMBL20909691 0.93 LMNA (0.52) LMNAGRIN2BSRD5A1FAAHTSHR
SCHEMBL13102446 0.89 LMNA (0.44) LMNAGRIN2BSRD5A1FAAHTSHR
Hydrochloric Acid SCHEMBL9342934 0.88 HTR2C (0.44) LMNAGRIN2BSRD5A1FAAHHTR2A
SCHEMBL20909795 0.85 FYN (0.44) LMNAGRIN2BSRD5A1ALDH1A1HTR2A
SCHEMBL15759195 0.85 GRIN2B (0.45) LMNAGRIN2BSRD5A1ALDH1A1
SCHEMBL15759191 0.83 SRD5A1 (0.44) LMNAGRIN2BSRD5A1ALDH1A1HTR1D
SCHEMBL10176999 0.83 SRD5A1 (0.44) LMNAGRIN2BSRD5A1ALDH1A1HTR1D
SCHEMBL15759171 0.83 SRD5A1 (0.44) LMNAGRIN2BSRD5A1ALDH1A1HTR1D
SCHEMBL15759219 0.83 SRD5A1 (0.44) LMNAGRIN2BSRD5A1ALDH1A1HTR1D

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
WO-2019074979-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF GIRAFPHARMA, LLC (US) 2019-04-18 WO disclosed