SCHEMBL9370327

SCHEMBL9370327

CC[N+](C)(C)c1nccnc1N1CCNCC1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 3/20 0.43
▸ EPHX2 P34913 1/20 0.40

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
SCHEMBL9376484 0.78 EPHX2 (0.50) HTR2CEPHX2
SCHEMBL13116668 0.75 HTR2C (0.56) HTR2CEPHX2
SCHEMBL18484592 0.73 HTR2C (0.45) HTR2CEPHX2
SCHEMBL13116676 0.71 HRH4 (0.44) HTR2CEPHX2
SCHEMBL23561114 0.71 HTR2C (0.49) HTR2CEPHX2
SCHEMBL9688903 0.69 HTR2C (0.42) HTR2CEPHX2
SCHEMBL122262 0.69 USP2 (0.55) HTR2CEPHX2
SCHEMBL9690012 0.68 ADRB2 (0.40) HTR2C
SCHEMBL27538607 0.68 HRH4 (0.42) HTR2C
SCHEMBL121912 0.67 HTR2C (0.49) HTR2CEPHX2

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-0594702-A1 SUBSTITUTED INDOLES AS ANTI-AIDS PHARMACEUTICALS. UPJOHN CO (US) 1994-05-04 — — EP disclosed
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