SCHEMBL7411673

SCHEMBL7411673

CN(C)C1CCc2[nH]c3cc(OC(=O)c4ccccc4)ccc3c2C1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR1F P30939 1/20 0.48
PRMT5 O14744 1/20 0.42
EGFR P00533 1/20 0.42
KMT2A Q03164 6/20 0.41
MEN1 O00255 3/20 0.41
MCHR1 Q99705 1/20 0.41
GRM5 P41594 1/20 0.40
ALDH1A1 P00352 2/20 0.40
PKM P14618 1/20 0.40
MAPT P10636 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
PDGFRB P09619 1/20 0.38
PDGFRA P16234 1/20 0.38
KDM4E B2RXH2 1/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
NPBWR1 P48145 1/20 0.38
HTR6 P50406 1/20 0.38
HSD17B10 Q99714 1/20 0.37

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
Benzil SCHEMBL11334399 0.84 MCHR1 (0.46) HTR1FEGFRMCHR1
SCHEMBL7415699 0.80 KMT2A (0.58) HTR1FKMT2AMEN1ALDH1A1MAPT
SCHEMBL7407989 0.80 HTR1D (0.55) HTR1FKMT2AMEN1ALDH1A1MAPT
SCHEMBL7410439 0.79 CTSV (0.46) HTR1FMCHR1TDP1
Hydrochloric Acid SCHEMBL7405179 0.79 HTR1D (0.54) HTR1FKMT2AMEN1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL7409171 0.78 CTSV (0.46) HTR1FEGFRMCHR1
Hydrochloric Acid SCHEMBL7406728 0.78 CTSV (0.46) HTR1FEGFRMCHR1
SCHEMBL7413343 0.78 MCHR1 (0.44) HTR1FMCHR1HTR6
SCHEMBL7406362 0.77 KMT2A (0.54) HTR1FKMT2AMEN1ALDH1A1MAPT
SCHEMBL7659409 0.77 HTR1F (0.61) HTR1FKMT2AMEN1ALDH1A1MAPT

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-3959309-A ANALGESICS, PSYCHOTROPIC, ANTIHISTAMINE STERLING DRUG INC. (US) 1976-05-25 US disclosed