SCHEMBL8414960

SCHEMBL8414960

c1cc(-c2nccs2)c2nn[nH]c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.41
PDPK1 O15530 1/20 0.40
GRM4 Q14833 1/20 0.38
ADRA1A P35348 3/20 0.37
ADRA1D P25100 2/20 0.37
ADRA1B P35368 1/20 0.36
LOXL2 Q9Y4K0 1/20 0.36
CYP2A6 P11509 1/20 0.36
RAB9A P51151 4/20 0.33
NPC1 O15118 3/20 0.33
ADORA2A P29274 2/20 0.33
ADORA1 P30542 2/20 0.33
JUN P05412 1/20 0.33
MAPK8 P45983 1/20 0.33
MAPK10 P53779 1/20 0.33
ADRA2A P08913 1/20 0.33
AR P10275 1/20 0.33
PKM P14618 2/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL30556736 0.77 METAP2 (0.38) PDPK1NPC1MAPK8MAPK10KMT2A
SCHEMBL31619990 0.77 METAP2 (0.38) PDPK1NPC1MAPK8MAPK10KMT2A
SCHEMBL411120 0.76 BRD4 (0.43) METAP1PDPK1ADRA1AADRA1DADRA1B
SCHEMBL6204009 0.75 PDPK1 (0.47) METAP1PDPK1GRM4LOXL2CYP2A6
SCHEMBL28284665 0.74 MGAM (0.41) RAB9ANPC1KMT2A
SCHEMBL810755 0.74 METAP1 (0.40) METAP1PDPK1GRM4ADRA1AADRA1D
SCHEMBL8743378 0.73 METAP1 (0.49) METAP1PDPK1ADRA1AADRA1DADRA1B
SCHEMBL8065287 0.73 METAP1 (0.49) METAP1PDPK1ADRA1AADRA1DADRA1B
SCHEMBL11768968 0.72 METAP2 (0.53) METAP1PDPK1CYP2A6ADORA2AADORA1
SCHEMBL26259560 0.72 PDPK1 (0.54) METAP1PDPK1ADRA1AADRA1DADRA1B

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-109679592-A A kind of solar energy heat conducting liquid and the preparation method and application thereof 中国石油化工股份有限公司 2019-04-26 CN claimed
CN-109679592-A A kind of solar energy heat conducting liquid and the preparation method and application thereof 中国石油化工股份有限公司 2019-04-26 CN disclosed
US-5935769-A POLYESTER SUPPORT IS A BIAXIALLY STRETCHED POLYESTER FILM OBTAINED FROM A NAPHTHALENEDICARBOXYLIC ACID AND A DIOL; THE DEVELOPING SOLUTION AND THE FIXING SOLUTION BEING PREPARED BY DISSOLVING, IN WATER, A SOLID DEVELOPING COMPOSITION AND A KONICA CORPORATION (JP) 1999-08-10 US disclosed
US-5266448-A Black and white developing bath FUJI PHOTO FILM CO., LTD. (JP) 1993-11-30 US disclosed