SCHEMBL3262852

SCHEMBL3262852

CCc1ccc(NC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.61
RAB9A P51151 5/20 0.51
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
MAPT P10636 3/20 0.51
KDM4E B2RXH2 1/20 0.51
LMNA P02545 1/20 0.51
POLB P06746 1/20 0.51
PKM P14618 1/20 0.51
MAPK1 P28482 1/20 0.51
IL18 Q14116 1/20 0.51
RAF1 P04049 2/20 0.49
EPHX2 P34913 1/20 0.49
NPC1 O15118 3/20 0.48
MAPK14 Q16539 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
P2RX3 P56373 4/20 0.46
BRAF P15056 3/20 0.46
TEK Q02763 1/20 0.45

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
SCHEMBL13363802 0.90 KMT2A (0.61) KDRRAB9AKMT2AMEN1MAPT
SCHEMBL3176040 0.83 KDR (0.54) KDRRAB9AKMT2AMEN1MAPT
SCHEMBL3183112 0.82 RAB9A (0.54) KDRRAB9AKMT2AMEN1MAPT
SCHEMBL3187673 0.81 RAB9A (0.77) KDRRAB9AKMT2AMEN1MAPT
SCHEMBL3183274 0.81 RAF1 (0.56) KDRRAB9AKMT2AMEN1MAPK1
SCHEMBL1381739 0.79 KDR (0.60) KDRRAB9AKMT2AMEN1MAPT
SCHEMBL13363786 0.78 KDR (0.58) KDRRAB9AKMT2AMEN1MAPT
SCHEMBL3410983 0.78 NPC1 (0.62) KDRRAB9AKMT2AMEN1MAPT
SCHEMBL13363791 0.78 CHEK1 (0.61) KDRRAB9AKMT2AMEN1MAPT
SCHEMBL3540677 0.77 KDR (0.54) KDRRAB9AKMT2AMEN1LMNA

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
US-7652022-B2 N-(4-(4-(4-hydroxyphenylamino)-pyrimidin-6-yl)-oxyphenyl)-N'-(3-trifluoromethylphenyl)-urea; NOVARTIS AG (CH) 2010-01-26 US disclosed
US-20060128734-A1 Diaryl urea derivatives useful for the treatment of protein kinase dependent diseases FLOERSHEIMER ANDREAS 2006-06-15 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-20060128734-A1 Diaryl urea derivatives useful for the treatment of protein kinase dependent diseases UCK2, PRKDC, PRKACA KDR 3898/4885RAB9A 1414/4885KMT2A 1452/4885

“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.