SCHEMBL20534145

SCHEMBL20534145

Cc1cc2nc(Cl)cc(N)n2n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.60
ALDH1A1 P00352 7/20 0.45
HPGD P15428 6/20 0.45
NPC1 O15118 5/20 0.45
RAB9A P51151 5/20 0.45
SMN1; SMN2 Q16637 5/20 0.45
HTT P42858 2/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
DPP4 P27487 1/20 0.43
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
MAPT P10636 4/20 0.42
TP53 P04637 3/20 0.42
LMNA P02545 2/20 0.42
CYP2C19 P33261 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
PKM P14618 1/20 0.41
CDK5 Q00535 1/20 0.41

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
SCHEMBL10388599 0.82 KDM4E (0.66) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL1934522 0.81 PDE10A (0.48) KDM4EHPGDNPC1RAB9ASMN1; SMN2
SCHEMBL14211725 0.81 NPC1 (0.47) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL1019063 0.74 KDM4E (0.47) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL11930695 0.73 KDM4E (0.54) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL1524183 0.73 KDM4E (0.46) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL10837052 0.71 KDM4E (0.74) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL15020938 0.71 TP53 (0.53) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL544920 0.71 RAB9A (0.45) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL16738973 0.70 KDM4E (0.44) KDM4EHPGDNPC1RAB9ASMN1; SMN2

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
US-20180298009-A1 Fused Pyrazole Derivatives As Kinase Inhibitors UCB BIOPHARMA SPRL (BE) 2018-10-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180298009-A1 Fused Pyrazole Derivatives As Kinase Inhibitors PI4KA, PI4K2B, PI4KB KDM4E 1098/4885ALDH1A1 3654/4885HPGD 3977/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.