SCHEMBL1302241

SCHEMBL1302241

CN(C)c1nc2cc(F)ccc2c(=O)n1N

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.39
▸ MPO P05164 2/20 0.38
▸ IDO1 P14902 2/20 0.38
▸ TDO2 P48775 2/20 0.38
▸ IDO2 Q6ZQW0 2/20 0.38
▸ TRPV4 Q9HBA0 3/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ GLA P06280 1/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ CASR P41180 1/20 0.36
▸ NQO2 P16083 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ HRH3 Q9Y5N1 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
SCHEMBL27899324 0.80 KDM4E (0.61) KDM4EMPOTRPV4L3MBTL1GLA
SCHEMBL4502928 0.77 LMNA (0.54) KDM4EMPOTRPV4L3MBTL1GLA
SCHEMBL1302732 0.72 TRPV4 (0.49) KDM4EMPOIDO1TDO2IDO2
SCHEMBL3700456 0.72 ATM (0.57) MPOTRPV4CASRHRH3
SCHEMBL30795730 0.70 RAB9A (0.39) MPOCYP3A4KMT2ACASR
SCHEMBL15840322 0.69 L3MBTL1 (0.49) MPOIDO1TDO2IDO2TRPV4
SCHEMBL15538380 0.68 KDM4E (0.61) KDM4EMPOIDO1TDO2IDO2
SCHEMBL13363284 0.67 PARP14 (0.43) KDM4E
SCHEMBL3708958 0.65 TDO2 (0.44) KDM4EMPOIDO1TDO2IDO2
SCHEMBL1161773 0.65 HDAC6 (0.42) KDM4ETRPV4CYP3A4L3MBTL1GLA

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-20110269783-A1 NOVEL 2,3-DIAMINO-QUINAZOLINONE DERIVATIVES AND THEIR MEDICAL USE NEUROSEARCH A/S (DK) 2011-11-03 — — 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-20110269783-A1 NOVEL 2,3-DIAMINO-QUINAZOLINONE DERIVATIVES AND THEIR MEDICAL USE KCNN3, KCNJ2, KCNN2 KDM4E 1937/4885MPO 2206/4885IDO1 3639/4885

“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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