SCHEMBL11528012

SCHEMBL11528012

CSc1cncnc1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HCAR2 Q8TDS4 2/20 0.39
KDM6B O15054 1/20 0.35
KDM4A O75164 1/20 0.35
KDM4D Q6B0I6 1/20 0.35
HIF1AN Q9NWT6 1/20 0.35
KDM2A Q9Y2K7 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
ALDH1A1 P00352 2/20 0.33
ALOX15 P16050 2/20 0.33
MAPT P10636 1/20 0.33
P4HA1 P13674 1/20 0.31
P4HTM Q9NXG6 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NAPRT Q6XQN6 1/20 0.31
HTT P42858 1/20 0.30
KMO O15229 1/20 0.30
SLC22A12 Q96S37 1/20 0.30

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
SCHEMBL27984896 0.83 AR (0.45) ARMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL27984838 0.83 AR (0.36) ARMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL28026566 0.80 L3MBTL1 (0.57) ARL3MBTL1ALDH1A1ALOX15MAPT
SCHEMBL11528761 0.76 ALDH1A1 (0.40) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL29269817 0.75 ICAM1 (0.42) MEN1KMT2AHCAR2L3MBTL1ALDH1A1
SCHEMBL3561461 0.74 HCAR2 (0.43) MEN1KMT2AHCAR2L3MBTL1ALDH1A1
SCHEMBL29957082 0.74 HCAR2 (0.43) MEN1KMT2AHCAR2L3MBTL1ALDH1A1
SCHEMBL28818787 0.73 AGBL2 (0.39) ARHCAR2ALDH1A1ALOX15MAPT
SCHEMBL38666287 0.72 MEN1 (0.45) ARMEN1KMT2AHCAR2KDM6B
SCHEMBL8882943 0.72 AR (0.43) ARMEN1KMT2AHCAR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109790166-A imidazopyridine compounds for the treatment of cancer 诺华股份有限公司 2019-05-21 CN disclosed
CN-104837829-A Inhibitor compounds CANCER REC TECH LTD 2015-08-12 CN disclosed
CN-104540834-A Novel thienopyrimidine derivatives, preparation method and therapeutic use thereof SANOFI SA 2015-04-22 CN disclosed
CN-104203925-A 5-aminopyrimidine derivatives and use thereof for combating undesired plant growth BAYER IP GMBH 2014-12-10 CN disclosed
US-4144339-A TREATMENT OF BILHARZIASIS RHONE-POULENC INDUSTRIES (FR) 1979-03-13 US disclosed
US-4138487-A NEMATOCIDES RHONE-POULENC INDUSTRIES (FR) 1979-02-06 US disclosed
US-4110450-A BILHARZIASIS RHONE-POULENC INDUSTRIES (FR) 1978-08-29 US disclosed