SCHEMBL9423409

SCHEMBL9423409

O=c1c(CCl)cc2ccccc2n1-c1cccc(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
LMNA P02545 1/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 2/20 0.41
KMT2A Q03164 1/20 0.40
DRD1 P21728 3/20 0.39
DRD5 P21918 3/20 0.39
F10 P00742 1/20 0.39
CCR2 P41597 1/20 0.39
FGFR1 P11362 1/20 0.38
MGLL Q99685 1/20 0.38
TSHR P16473 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
PMM2 O15305 1/20 0.38
G6PD P11413 1/20 0.38
MPI P34949 1/20 0.38

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
SCHEMBL9423391 0.88 ALDH1A1 (0.49) KDM4EGAAALDH1A1KMT2ATSHR
SCHEMBL9423446 0.83 TDP2 (0.50) LMNAKMT2ACYP1A2
SCHEMBL9423386 0.78 CYP19A1 (0.44) KDM4ELMNARAB9AALDH1A1DRD1
SCHEMBL9423493 0.77 ALDH1A1 (0.46) KDM4EGAAALDH1A1KMT2ATSHR
SCHEMBL9395502 0.73 ALDH1A1 (0.49) KDM4EGAAALDH1A1KMT2ATSHR
SCHEMBL30162776 0.72 DAO (0.57) KDM4EGAALMNAKMT2A
SCHEMBL2113080 0.72 DAO (0.57) KDM4EGAALMNAKMT2A
SCHEMBL3968107 0.71 ALDH1A1 (0.77) ALDH1A1F10CCR2TSHR
SCHEMBL28707236 0.70 KDM4E (0.51) KDM4EGAALMNARAB9AKMT2A
SCHEMBL9423502 0.70 ALDH1A1 (0.45) KDM4EGAAALDH1A1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5318971-A Also antihyperproliferative skin disease agents, e.g. psoriaisis; side effect reduction SCHERING CORPORATION (US) 1994-06-07 US disclosed
US-5064837-A Antiallergens SCHERING CORPORATION (US) 1991-11-12 US disclosed
WO-1991007401-A1 3-SUBSTITUTED-1-(ARYL OR ARYLALKYL)-2(1H)-QUINOLINONES SCHERING CORPORATION (US) 1991-05-30 WO disclosed