SCHEMBL21084580

SCHEMBL21084580

Cc1cc(Cc2ccc(Cl)cc2)ccc1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.53
SKP2 Q13309 1/20 0.50
ALDH1A1 P00352 6/20 0.44
KDM4E B2RXH2 3/20 0.44
GAA P10253 3/20 0.44
POLB P06746 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ESR1 P03372 2/20 0.44
ESR2 Q92731 2/20 0.44
MAPT P10636 2/20 0.44
RAB9A P51151 1/20 0.44
TSHR P16473 4/20 0.43
TDP1 Q9NUW8 2/20 0.43
HSP90AB1 P08238 1/20 0.43
CYP2C19 P33261 1/20 0.42
HIF1A Q16665 1/20 0.42
ALOX15 P16050 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPC1 O15118 1/20 0.40

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
SCHEMBL3482071 0.90 SKP2 (0.59) CYP3A4SKP2ALDH1A1KDM4EGAA
SCHEMBL31079561 0.88 SKP2 (0.61) CYP3A4SKP2ALDH1A1KDM4EGAA
SCHEMBL237201 0.88 SKP2 (0.61) CYP3A4SKP2ALDH1A1KDM4EGAA
SCHEMBL551693 0.87 CYP3A4 (0.52) CYP3A4SKP2ALDH1A1KDM4EGAA
Hydrochloric Acid SCHEMBL8644397 0.86 SKP2 (0.59) CYP3A4SKP2ALDH1A1KDM4EGAA
Ammonia Solution, Strong SCHEMBL22344976 0.86 SKP2 (0.59) CYP3A4SKP2ALDH1A1KDM4EGAA
Hydrochloric Acid SCHEMBL2929105 0.86 SKP2 (0.59) CYP3A4SKP2ALDH1A1KDM4EGAA
4,4'-Methylenedianiline SCHEMBL10832019 0.84 CYP3A4 (0.58) CYP3A4SKP2ALDH1A1KDM4EGAA
SCHEMBL9309437 0.84 CYP3A4 (0.58) CYP3A4SKP2ALDH1A1KDM4EGAA
SCHEMBL8086634 0.84 SKP2 (0.58) CYP3A4SKP2ALDH1A1KDM4EGAA

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
CN-108884032-B Method for preparing poly (carbonate-etherimide) compounds PTT全球化学股份有限公司 2021-10-15 CN disclosed
US-10759904-B2 Method for preparing poly(carbonate-etherimide) compound PTT GLOBAL CHEMICAL PUBLIC COMPANY LIMITED (TH) 2020-09-01 US disclosed
US-20190202980-A1 METHOD FOR PREPARING POLY(CARBONATE-ETHERIMIDE) COMPOUND PTT GLOBAL CHEMICAL PUBLIC COMPANY LIMITED (TH) 2019-07-04 US disclosed
CN-108884032-A The method for preparing poly- (carbonic ester-etherimide) compound PTT全球化学股份有限公司 2018-11-23 CN disclosed