SCHEMBL10058752

SCHEMBL10058752

CCCc1nnc(-c2ccc3cc(-c4nnc(CCC)s4)ccc3c2)s1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
QPCTL Q9NXS2 8/20 0.40
QPCT Q16769 3/20 0.40
RAB9A P51151 4/20 0.40
KDM4E B2RXH2 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
MAPT P10636 2/20 0.39
NPC1 O15118 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 1/20 0.39
SUCNR1 Q9BXA5 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
SNCA P37840 1/20 0.38
PTPN11 Q06124 1/20 0.37
TP53 P04637 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL10058824 0.97 QPCTL (0.39) QPCTLQPCTRAB9AKDM4ESMN1; SMN2
SCHEMBL10058849 0.97 QPCTL (0.39) QPCTLQPCTRAB9AKDM4ESMN1; SMN2
SCHEMBL10058769 0.95 QPCTL (0.39) QPCTLQPCTRAB9AKDM4ESMN1; SMN2
SCHEMBL10058754 0.92 RAB9A (0.45) QPCTLQPCTRAB9AKDM4ESMN1; SMN2
SCHEMBL10058825 0.89 RAB9A (0.43) QPCTLQPCTRAB9AKDM4ESMN1; SMN2
SCHEMBL10058848 0.89 RAB9A (0.43) QPCTLQPCTRAB9AKDM4ESMN1; SMN2
SCHEMBL10058747 0.89 RAB9A (0.50) QPCTLQPCTRAB9AKDM4ESMN1; SMN2
SCHEMBL10058912 0.88 MAPT (0.36) QPCTLQPCTRAB9AKDM4EMAPT
SCHEMBL10058741 0.87 RAB9A (0.49) QPCTLQPCTRAB9AKDM4ESMN1; SMN2
SCHEMBL10058758 0.87 RAB9A (0.49) QPCTLQPCTRAB9AKDM4ESMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8480926-B2 Liquid-crystalline compound and organic semiconductor device containing the compound JNC CORPORATION (JP) 2013-07-09 US disclosed
US-8480926-B2 Liquid-crystalline compound and organic semiconductor device containing the compound JNC CORPORATION (JP) 2013-07-09 US disclosed
US-20120007062-A1 NOVEL LIQUID-CRYSTALLINE COMPOUND AND ORGANIC SEMICONDUCTOR DEVICE CONTAINING THE COMPOUND JNC CORPORATION (JP) 2012-01-12 US disclosed
US-20120007062-A1 NOVEL LIQUID-CRYSTALLINE COMPOUND AND ORGANIC SEMICONDUCTOR DEVICE CONTAINING THE COMPOUND JNC CORPORATION (JP) 2012-01-12 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-20120007062-A1 NOVEL LIQUID-CRYSTALLINE COMPOUND AND ORGANIC SEMICONDUCTOR DEVICE CONTAINING THE COMPOUND ARNT, SLCO2A1, CRY2 QPCTL 668/4885QPCT 1408/4885RAB9A 1757/4885

“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.