SCHEMBL30263192

SCHEMBL30263192

NC(=O)c1cnc(N2CCOCC2)nc1-c1nc(-c2ccccc2Cl)cs1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.52
CYP1B1 Q16678 1/20 0.52
HTR2C P28335 5/20 0.47
CCNA2 P20248 1/20 0.43
CDK2 P24941 1/20 0.43
CCNA1 P78396 1/20 0.43
CDK5 Q00535 1/20 0.43
CDK5R1 Q15078 1/20 0.43
PTPN11 Q06124 1/20 0.43
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP19A1 P11511 1/20 0.42
CAMK1D Q8IU85 1/20 0.42
CNR2 P34972 4/20 0.41
AR P10275 1/20 0.41
STAT6 P42226 1/20 0.41
AKT1 P31749 1/20 0.40
PIK3CA P42336 1/20 0.40

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
SCHEMBL30263188 0.85 AOC3 (0.42) CYP1A1CYP1B1HTR2CPTPN11KDM4E
SCHEMBL30292485 0.85 CYP1A1 (0.53) CYP1A1CYP1B1HTR2CCCNA2CDK2
SCHEMBL30263345 0.81 CYP1A1 (0.52) CYP1A1CYP1B1HTR2CCCNA2CDK2
SCHEMBL30263215 0.80 CYP1B1 (0.61) CYP1A1CYP1B1HTR2CCCNA2CDK2
SCHEMBL30263390 0.79 SMN1; SMN2 (0.49) CYP1A1CYP1B1KDM4ENPC1RAB9A
SCHEMBL30263245 0.79 CYP1A1 (0.51) CYP1A1CYP1B1HTR2CCCNA2CDK2
SCHEMBL30263260 0.79 CYP1B1 (0.57) CYP1A1CYP1B1HTR2CCCNA2CDK2
SCHEMBL2954462 0.77 PTPN11 (0.52) HTR2CPTPN11KDM4ERAB9ASMN1; SMN2
SCHEMBL30263173 0.77 NPC1 (0.47) CYP1A1CYP1B1KDM4ENPC1RAB9A
SCHEMBL30263185 0.76 CYP1A1 (0.53) CYP1A1CYP1B1HTR2CCCNA2CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4161921-A1 COLLAGEN 1 TRANSLATION INHIBITORS AND METHODS OF USE THEREOF Anima Biotech Inc. (US) 2023-04-12 EP disclosed