SCHEMBL9027014

SCHEMBL9027014

Cc1cc(C[O])ccc1N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.57
CYP3A4 P08684 7/20 0.50
ALDH1A1 P00352 6/20 0.50
TDP1 Q9NUW8 5/20 0.50
TSHR P16473 2/20 0.50
S100B P04271 1/20 0.44
ESR1 P03372 3/20 0.39
ESR2 Q92731 2/20 0.39
AR P10275 1/20 0.39
MAPK1 P28482 1/20 0.39
RAD52 P43351 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
THRB P10828 3/20 0.37
ALOX15 P16050 3/20 0.37
HIF1A Q16665 2/20 0.37
RECQL P46063 1/20 0.37
GAA P10253 2/20 0.37
CYP1A2 P05177 1/20 0.37
CASP7 P55210 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
SCHEMBL237201 0.81 SKP2 (0.61) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL31079561 0.81 SKP2 (0.61) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL31634603 0.81 SKP2 (0.73) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL841783 0.81 SKP2 (0.73) SKP2CYP3A4ALDH1A1TDP1TSHR
Hydrochloric Acid SCHEMBL8644397 0.79 SKP2 (0.59) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL3482834 0.79 SKP2 (0.70) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL3482071 0.79 SKP2 (0.59) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL7747249 0.79 SKP2 (0.64) SKP2CYP3A4ALDH1A1TDP1TSHR
Ammonia Solution, Strong SCHEMBL22344976 0.79 SKP2 (0.59) SKP2CYP3A4ALDH1A1TDP1TSHR
SCHEMBL2036306 0.79 SKP2 (0.59) SKP2CYP3A4ALDH1A1TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0411150-B1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMA CO LTD (JP) 1996-11-27 EP disclosed
US-5459142-A Autoimmune disease, atherosclerosis, antiischemic agents and nephritis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-10-17 US disclosed
EP-0511879-B1 Pyrazine derivatives OTSUKA PHARMA CO LTD (JP) 1995-03-22 EP disclosed
US-5238938-A Nephrosis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-08-24 US disclosed
EP-0511879-A1 Pyrazine derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-11-04 EP disclosed
EP-0411150-A1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-02-06 EP disclosed