SCHEMBL10058769

SCHEMBL10058769

CCCc1nnc(-c2ccc3ccc(-c4nnc(CCC)s4)cc3c2)s1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
QPCTL Q9NXS2 10/20 0.39
QPCT Q16769 5/20 0.39
KDM4E B2RXH2 2/20 0.39
RAB9A P51151 1/20 0.39
SUCNR1 Q9BXA5 1/20 0.38
MAPT P10636 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SNCA P37840 1/20 0.37
PTPN11 Q06124 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL10058849 0.95 QPCTL (0.39) QPCTLQPCTKDM4ERAB9ASUCNR1
SCHEMBL10058824 0.95 QPCTL (0.39) QPCTLQPCTKDM4ERAB9ASUCNR1
SCHEMBL10058752 0.95 QPCTL (0.40) QPCTLQPCTKDM4ERAB9ASUCNR1
SCHEMBL10058768 0.92 RAB9A (0.44) QPCTLQPCTKDM4ERAB9ASUCNR1
SCHEMBL10058774 0.89 RAB9A (0.49) QPCTLQPCTKDM4ERAB9ASUCNR1
SCHEMBL10058777 0.88 RAB9A (0.48) QPCTLQPCTKDM4ERAB9ASUCNR1
SCHEMBL10058776 0.88 RAB9A (0.48) QPCTLQPCTKDM4ERAB9ASUCNR1
SCHEMBL10058763 0.88 RAB9A (0.48) QPCTLQPCTKDM4ERAB9ASUCNR1
SCHEMBL15095119 0.88 RAB9A (0.48) QPCTLQPCTKDM4ERAB9ASUCNR1
SCHEMBL10058770 0.88 RAB9A (0.48) QPCTLQPCTKDM4ERAB9ASUCNR1

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 1408/4885KDM4E 3424/4885

“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.