SCHEMBL8000191

SCHEMBL8000191

Cc1ccc(C(=O)c2ccc(Cc3c(Cl)cc(N)cc3Cl)cc2)cn1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR9 P51686 3/20 0.39
VNN1 O95497 5/20 0.39
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
SRD5A2 P31213 1/20 0.38
KDM4E B2RXH2 1/20 0.36
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.35
GRM5 P41594 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL8002841 0.87 NAPRT (0.43) VNN1KMT2A
SCHEMBL8002494 0.84 VNN1 (0.36) VNN1HDAC1SRD5A2TSHR
SCHEMBL8000142 0.84 RAB9A (0.39) VNN1SRD5A2KMT2ANPSR1
SCHEMBL8001938 0.84 SRD5A2 (0.54) SRD5A2
SCHEMBL7998751 0.84 VNN1 (0.42) VNN1KDM4EKMT2A
SCHEMBL8000281 0.83 MEN1 (0.46) CCR9SRD5A2KDM4EKMT2ANPSR1
SCHEMBL7484185 0.81 SRD5A2 (0.44) VNN1SRD5A2KDM4EKMT2A
SCHEMBL7998602 0.79 RECQL (0.36) VNN1SRD5A2
SCHEMBL7838560 0.77 KMT2A (0.56) KDM4EKMT2ATSHR
SCHEMBL7998767 0.76 KMT2A (0.42) KDM4EKMT2ANPSR1

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
CN-1159302-C Triazine derivatives, their preparation and use ��������-���Ͷ��ﱣ����ʽ���� 2004-07-28 CN disclosed
US-6294536-B1 CONTROL OF PROTOZOA AND REDUCTION IN THE INCIDENCE OF ASSOCIATED DISEASES AND DEATH AND CONSEQUENT IMPROVEMENT IN RETARDED GROWTH AND GENERAL CONDITION AND PREVENTING DECREASE GROWTH AND GENERAL CONDITION TAKEDA SCHERING-PLOUGH ANIMAL HEALTH K.K. (JP) 2001-09-25 US disclosed
CN-1263526-A Triazine derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2000-08-16 CN disclosed