SCHEMBL7278393

SCHEMBL7278393

O=C1CCCc2cc3ccccc3n21

nearest known ligand 0.80

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.80
HTR2A P28223 5/20 0.39
HTR2C P28335 5/20 0.39
ALDH1A1 P00352 3/20 0.38
TSHR P16473 1/20 0.38
DAO P14920 1/20 0.35
SIGMAR1 Q99720 4/20 0.35
APP P05067 1/20 0.35
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
SLC9A1 P19634 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
SCHEMBL30615209 0.89 NOTUM (1.00) NOTUMHTR2AHTR2CALDH1A1TSHR
SCHEMBL9259627 0.89 NOTUM (1.00) NOTUMHTR2AHTR2CALDH1A1TSHR
SCHEMBL11096746 0.79 NOTUM (0.51) NOTUMALDH1A1MEN1HPGDKMT2A
SCHEMBL31534628 0.77 NOTUM (0.53) NOTUMHTR2AHTR2CALDH1A1TSHR
SCHEMBL7379739 0.74 NOTUM (0.62) NOTUMHTR2AHTR2CALDH1A1TSHR
SCHEMBL12598325 0.70 NOTUM (0.57) NOTUMHTR2AHTR2CALDH1A1TSHR
SCHEMBL3145492 0.70 NOTUM (0.44) NOTUMHTR2AHTR2CALDH1A1TSHR
SCHEMBL3145472 0.70 NOTUM (0.44) NOTUMHTR2AHTR2CALDH1A1TSHR
SCHEMBL34463390 0.69 NOTUM (0.56) NOTUMHTR2AHTR2CALDH1A1TSHR
SCHEMBL7396809 0.69 NOTUM (0.56) NOTUMHTR2AHTR2CALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0451538-B1 Use of pyridoindole derivatives in the treatment of ischemic disorders FUJISAWA PHARMACEUTICAL CO (JP) 1996-05-22 EP disclosed
EP-0361317-B1 Pyridoindole derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 1995-04-05 EP disclosed
EP-0384349-B1 Substituted pyrroles HOFFMANN LA ROCHE (CH) 1994-04-27 EP disclosed
US-5290785-A Therapeutic agent for ischemic diseases FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-03-01 US disclosed
US-5173493-A For treatment or prevention of nausea or vomiting FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1992-12-22 US disclosed
US-5141945-A 5-Hydroxytryptamine antagonists, treatment or prevention of nausea and vomiting FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1992-08-25 US disclosed
EP-0451538-A2 Use of pyridoindole derivatives in the treatment of ischemic disorders FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-10-16 EP disclosed
EP-0384349-A1 Substituted pyrroles F. HOFFMANN-LA ROCHE AG (CH) 1990-08-29 EP disclosed
EP-0361317-A2 Pyridoindole derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-04-04 EP disclosed