SCHEMBL8962986

SCHEMBL8962986

Nc1cc(C(=O)c2cccc(C(=O)c3ccc(Cl)c(N)c3)c2)ccc1Cl

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.52
ATM Q13315 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
PBRM1 Q86U86 1/20 0.48
KDM4E B2RXH2 1/20 0.47
SRD5A2 P31213 1/20 0.47
POLB P06746 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPK1 P28482 2/20 0.46
VCAM1 P19320 2/20 0.46
LMNA P02545 3/20 0.46
NPC1 O15118 1/20 0.46
MITF O75030 1/20 0.46
GAA P10253 2/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
MGAM O43451 1/20 0.46
AMY1A P0DUB6 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46

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
SCHEMBL312298 0.92 SRD5A2 (0.53) L3MBTL1KDM4ESRD5A2POLBALDH1A1
SCHEMBL9859728 0.91 VCAM1 (0.57) L3MBTL1ATMTDP1PBRM1KDM4E
SCHEMBL9464665 0.85 TP53 (0.54) L3MBTL1TDP1KDM4ESRD5A2ALDH1A1
SCHEMBL9464836 0.81 LMNA (0.57) L3MBTL1KDM4ESRD5A2ALDH1A1MAPK1
SCHEMBL7913711 0.80 KDM4E (0.50) TDP1KDM4EPOLBALDH1A1MAPK1
SCHEMBL51027 0.78 TSHR (0.65) L3MBTL1ATMTDP1KDM4ESRD5A2
SCHEMBL29622719 0.78 TSHR (0.65) L3MBTL1ATMTDP1KDM4ESRD5A2
SCHEMBL1808714 0.78 KDM4E (0.51) KDM4EALDH1A1LMNANPC1GAA
SCHEMBL30912248 0.78 ALDH1A1 (0.77) ATMKDM4EPOLBALDH1A1LMNA
SCHEMBL614963 0.78 ALDH1A1 (0.77) ATMKDM4EPOLBALDH1A1LMNA

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
EP-0474501-B1 Aromatic diamine compound, preparation process of same and polyimide prepared from same MITSUI TOATSU CHEMICALS (JP) 1996-02-14 EP disclosed
US-5322962-A Produce polyimides with high heat and chemical resistance, processability MITSUI TOATSU CHEMICALS, INC. (JP) 1994-06-21 US disclosed
US-5231160-A AROMATIC DIAMINE COMPOUND, PREPARATION PROCESS OF SAME AND POLYIMIDE PREPARED FROM SAME MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1993-07-27 US disclosed
EP-0474501-A1 Aromatic diamine compound, preparation process of same and polyimide prepared from same MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-03-11 EP disclosed