SCHEMBL10901276

SCHEMBL10901276

CCOC(=O)c1cc2c(nc1C)/C(=C\c1ccco1)CCC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.44
NPC1 O15118 3/20 0.44
CASP3 P42574 1/20 0.44
ATM Q13315 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
MAPT P10636 8/20 0.43
L3MBTL1 Q9Y468 6/20 0.43
ALDH1A1 P00352 6/20 0.43
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
POLB P06746 4/20 0.43
BLM P54132 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TSHR P16473 2/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
KDM4E B2RXH2 7/20 0.42

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
SCHEMBL10901280 1.00 RAB9A (0.44) RAB9ANPC1CASP3ATMSENP8
SCHEMBL10899038 0.83 RAB9A (0.47) RAB9ANPC1CASP3ATMSENP8
SCHEMBL10899031 0.83 RAB9A (0.47) RAB9ANPC1CASP3ATMSENP8
SCHEMBL7910347 0.81 KDM4E (0.46) RAB9ANPC1CASP3ATMSENP8
SCHEMBL7910349 0.81 KDM4E (0.46) RAB9ANPC1CASP3ATMSENP8
SCHEMBL7910341 0.81 KDM4E (0.46) RAB9ANPC1CASP3ATMSENP8
SCHEMBL10898042 0.80 MAPT (0.45) RAB9ANPC1CASP3ATMSENP8
SCHEMBL10899069 0.80 MAPT (0.45) RAB9ANPC1CASP3ATMSENP8
SCHEMBL7902756 0.77 CYP19A1 (0.47) RAB9ANPC1CASP3ATMSENP8
SCHEMBL10899381 0.77 NPC1 (0.44) RAB9ANPC1CASP3ATMSENP8

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
US-4576949-A Use of 5,6,7,8-tetrahydroquinolines and 5,6-dihydropyrindines as leukotriene and lipoxygenase inhibitors and the novel 3-substituted compounds therein THE UPJOHN COMPANY (US) 1986-03-18 US claimed
EP-0161867-A2 5,6,7,8-Tetrahydroquinolines and 5,6-dihydropyrindines and their therapeutic use THE UPJOHN COMPANY (US) 1985-11-21 EP claimed
US-4576949-A Use of 5,6,7,8-tetrahydroquinolines and 5,6-dihydropyrindines as leukotriene and lipoxygenase inhibitors and the novel 3-substituted compounds therein THE UPJOHN COMPANY (US) 1986-03-18 US disclosed
EP-0161867-A2 5,6,7,8-Tetrahydroquinolines and 5,6-dihydropyrindines and their therapeutic use THE UPJOHN COMPANY (US) 1985-11-21 EP disclosed