SCHEMBL7977117

SCHEMBL7977117

CCNc1cccc(O)c1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.47
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
G6PD P11413 2/20 0.40
TSHR P16473 2/20 0.40
CYP3A4 P08684 1/20 0.40
RECQL P46063 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 4/20 0.39
ALDH1A1 P00352 3/20 0.39
GAA P10253 2/20 0.39
HTT P42858 2/20 0.39
KDM4E B2RXH2 2/20 0.39
THRB P10828 2/20 0.39
HPGD P15428 1/20 0.39
GFER P55789 1/20 0.39
PLEC Q15149 1/20 0.39
CASP7 P55210 2/20 0.38
CA12 O43570 1/20 0.38
CA2 P00918 1/20 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
SCHEMBL27859512 0.85 MEN1 (0.43) IDO1MEN1KMT2ATSHRCYP3A4
SCHEMBL6118035 0.79 CD44 (0.43) IDO1MEN1KMT2ATSHRCYP3A4
SCHEMBL4624627 0.79 IDO1 (0.50) IDO1MEN1KMT2AG6PDTSHR
SCHEMBL1368372 0.79 IDO1 (0.59) IDO1MEN1KMT2AG6PDTSHR
Hydrochloric Acid SCHEMBL25292962 0.78 IDO1 (0.48) IDO1MEN1KMT2AG6PDTSHR
SCHEMBL1953525 0.78 IDO1 (0.48) IDO1MEN1KMT2AG6PDTSHR
SCHEMBL3194480 0.78 MAPT (0.50) IDO1MEN1KMT2AG6PDTSHR
SCHEMBL27466376 0.78 CD44 (0.46) IDO1MEN1KMT2ATSHRCYP3A4
SCHEMBL3790317 0.77 IDO1 (0.37) IDO1MEN1KMT2AG6PDTSHR
Hydrochloric Acid SCHEMBL28211867 0.77 IDO1 (0.57) IDO1MEN1KMT2AG6PDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6194396-B1 ANTIALLERGENS; ANTIINFLAMMATION AGENTS; AUTOIMMUNE DISEASE; ANTISHOCK AGENTS; ANALGESICS; E.G., A 4 OR 7-PHENYLALKYLENE-OXYBENZIMIDAZOLE UNSUBSTITUTED OR SUBSTITUTED IN THE 1,2,3-POSITION WITH AN OXY, AMINO AND/OR THIO GROUP FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-02-27 US disclosed
US-6083961-A FOR PREVENTION AND/OR TREATMENT OF BRADYKININ OR ITS ANALOGUES MEDIATED DISEASES SUCH AS ALLERGY, INFLAMMATION, AUTOIMMUNE DISEASE, SHOCK, PAIN FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-07-04 US disclosed
EP-0774462-A1 HETEROCYCLIC COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-21 EP disclosed