SCHEMBL26517166

SCHEMBL26517166

N=C(NCc1ccc(Cl)cc1)c1cccc(N)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
F2 P00734 1/20 0.44
PLG P00747 1/20 0.44
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44
TSHR P16473 1/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
F10 P00742 1/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
LMNA P02545 1/20 0.40
ALOX12 P18054 2/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 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
SCHEMBL26485477 0.86 CYP1A2 (0.47) CYP2C9CYP2C19MEN1KMT2AF2
SCHEMBL26482610 0.86 KMT2A (0.47) CYP2C9CYP2C19MEN1KMT2ATSHR
SCHEMBL26519908 0.84 EPHX2 (0.47) F2PLGPRSS1PRSS2PRSS3
SCHEMBL26485572 0.82 GAA (0.44) F2PLGPRSS1PRSS2PRSS3
SCHEMBL26482347 0.81 CYP2C19 (0.50) CYP2C9CYP2C19MEN1KMT2AMAPT
SCHEMBL26107518 0.78 MEN1 (0.44) MEN1KMT2ATSHRMAPTALDH1A1
SCHEMBL26482559 0.77 CYP2C19 (0.43) CYP2C9CYP2C19MEN1KMT2AMAPT
SCHEMBL26482402 0.74 CYP2C19 (0.43) CYP2C9CYP2C19MEN1KMT2AMAPT
SCHEMBL26482286 0.73 CYP2C19 (0.47) CYP2C9CYP2C19MEN1KMT2ACA1
SCHEMBL7840700 0.72 MEN1 (0.58) CYP2C9CYP2C19MEN1KMT2ACA1

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
WO-2023183886-A2 COMPOSITIONS FOR AND METHODS OF MODULATING RNA STABILITY DUKE UNIVERSITY (US) 2023-09-28 WO disclosed