SCHEMBL9207461

SCHEMBL9207461

CCOC(=O)c1cccc2c1NC(C)CC2Sc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
POLB P06746 2/20 0.43
TSHR P16473 2/20 0.43
GAA P10253 1/20 0.43
BRD4 O60885 1/20 0.42
CREBBP Q92793 1/20 0.42
ALDH1A1 P00352 7/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.39
DHFR P00374 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
USP2 O75604 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
ALOX15 P16050 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAPK10 P53779 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
SCHEMBL7127415 0.74 TSHR (0.46) MAPTPOLBTSHRGAAALDH1A1
Hydrochloric Acid SCHEMBL9205600 0.69 MAPT (0.39) MAPTTSHRBRD4CREBBPALDH1A1
Diethyl Phthalate SCHEMBL27742347 0.66 TSHR (0.95) MAPTTSHRALDH1A1L3MBTL1MAPK1
Diethyl Phthalate SCHEMBL19252611 0.66 TSHR (0.95) TSHRALDH1A1L3MBTL1MAPK1HSD17B10
Diethyl Phthalate SCHEMBL7520316 0.66 TSHR (0.95) MAPTTSHRALDH1A1L3MBTL1MAPK1
Diethyl Phthalate SCHEMBL28775845 0.66 TSHR (0.95) TSHRALDH1A1L3MBTL1MAPK1HSD17B10
SCHEMBL16752384 0.65 TSHR (0.65) MAPTPOLBTSHRALDH1A1L3MBTL1
Diethyl Phthalate SCHEMBL28168029 0.65 TSHR (0.91) TSHRALDH1A1L3MBTL1MAPK1HSD17B10
Diethyl Phthalate SCHEMBL22296 0.64 TSHR (1.00) MAPTTSHRALDH1A1L3MBTL1MAPK1
Diethyl Phthalate SCHEMBL29404255 0.64 TSHR (1.00) MAPTTSHRALDH1A1L3MBTL1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0385271-B1 Tetrahydroquinolines and method of preparation EASTMAN KODAK CO (US) 1995-10-25 EP disclosed
EP-0385271-A1 Tetrahydroquinolines and method of preparation EASTMAN KODAK COMPANY (US) 1990-09-05 EP disclosed