SCHEMBL14182349

SCHEMBL14182349

Cc1cccc(NC=N)n1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ GRM5 P41594 6/20 0.44
▸ HSD17B10 Q99714 2/20 0.43
▸ FDPS P14324 1/20 0.43
▸ FDFT1 P37268 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ CCR1 P32246 1/20 0.43
▸ CCR8 P51685 1/20 0.43
▸ NPC1 O15118 1/20 0.42
▸ GBA1 P04062 1/20 0.42
▸ NPSR1 Q6W5P4 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
SCHEMBL14182355 0.79 MEN1 (0.31) KMT2AMEN1RAB9AKDM4E
SCHEMBL11712255 0.79 RAB9A (0.55) KMT2AMEN1RAB9AGRM5HSD17B10
SCHEMBL1861757 0.79 RAB9A (0.55) KMT2AMEN1RAB9AGRM5HSD17B10
SCHEMBL7294068 0.75 MEN1 (0.31) KMT2AMEN1RAB9AKDM4E
SCHEMBL229747 0.75 RAB9A (0.59) KMT2AMEN1RAB9AGRM5HSD17B10
SCHEMBL30558522 0.73 — —
SCHEMBL306134 0.73 — —
SCHEMBL9588376 0.72 KMT2A (0.52) KMT2AMEN1RAB9AGRM5HSD17B10
SCHEMBL11707702 0.72 MEN1 (0.43) KMT2AMEN1RAB9AGRM5HSD17B10
SCHEMBL10138645 0.71 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101490038-B Pyrimidine derivatives as ALK-5 inhibitors NOVARTIS AG 2013-08-14 — — CN disclosed
US-20080108600-A1 Polycyclic Pyridines as Potassium Ion Channel Modulators ICAGEN, INC. (US) 2008-05-08 — — 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-20080108600-A1 Polycyclic Pyridines as Potassium Ion Channel Modulators KCNJ2, KCNH2, KCNQ1 KMT2A 563/4885MEN1 2428/4885RAB9A 3132/4885

“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.

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