SCHEMBL9200463

SCHEMBL9200463

CCCc1[nH]c2ccc(OC)cc2c1CC

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 8/20 0.75
HTR1D P28221 3/20 0.64
HTR1A P08908 2/20 0.64
HTR1E P28566 2/20 0.64
HTR7 P34969 2/20 0.64
HTR5A P47898 2/20 0.64
HTR2A P28223 2/20 0.64
HTR2C P28335 1/20 0.64
ALDH1A1 P00352 5/20 0.57
KDM4E B2RXH2 4/20 0.57
MAPT P10636 3/20 0.57
MCL1 Q07820 1/20 0.57
RXFP1 Q9HBX9 1/20 0.57
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
HSD17B10 Q99714 3/20 0.56
TSHR P16473 1/20 0.56
GFER P55789 1/20 0.56
ATM Q13315 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53

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
SCHEMBL7952945 0.84 HTR6 (0.62) HTR6HTR1DHTR1AHTR1EHTR7
SCHEMBL31543684 0.81 MTNR1A (0.75) ALDH1A1KDM4EHSD17B10TSHRHPGD
SCHEMBL11374190 0.81 ALDH1A1 (0.78) HTR6HTR1DHTR1AHTR1EHTR7
SCHEMBL8691195 0.81 HTR6 (0.71) HTR6HTR1DHTR1AHTR1EHTR7
SCHEMBL15902322 0.80 AHR (0.59) HTR6HTR1DHTR1AHTR1EHTR7
SCHEMBL26227993 0.79 HSD17B10 (0.56) HTR6HTR1DHTR2AALDH1A1KDM4E
SCHEMBL29389149 0.79 HTR6 (1.00) HTR6HTR1DHTR1AHTR1EHTR7
SCHEMBL2537573 0.79 HTR6 (1.00) HTR6HTR1DHTR1AHTR1EHTR7
SCHEMBL9209940 0.78 MEN1 (0.54) HTR6HTR1DHTR1AHTR1EHTR7
SCHEMBL22722590 0.78 HTR6 (0.59) HTR6HTR1DHTR1AHTR1EHTR7

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0544821-B1 INDOLE DERIVATIVES AS ANTIALLERGY AND ANTIINFLAMMATORY AGENTS PFIZER (US) 1995-01-11 EP disclosed
US-5290788-A Indole derivatives as antiallergy and antiinflammatory agents PFIZER INC. (US) 1994-03-01 US disclosed
EP-0544821-A1 INDOLE DERIVATIVES AS ANTIALLERGY AND ANTIINFLAMMATORY AGENTS. PFIZER (US) 1993-06-09 EP disclosed
WO-1992006088-A1 INDOLE DERIVATIVES AS ANTIALLERGY AND ANTIINFLAMMATORY AGENTS PFIZER INC. (US) 1992-04-16 WO disclosed