SCHEMBL5747463

SCHEMBL5747463

Cc1cc(C)cc(-c2cc3cnccc3nc2NC(=O)NC2CCCCC2)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 5/20 0.46
POLB P06746 1/20 0.46
GAA P10253 1/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
AAK1 Q2M2I8 1/20 0.43
PRMT3 O60678 2/20 0.42
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
EPHX2 P34913 1/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
JAK3 P52333 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL5748571 0.91 NPC1 (0.51) EPHX1POLBGAANPC1RAB9A
SCHEMBL5747448 0.86 NPC1 (0.45) EPHX1POLBGAANPC1RAB9A
SCHEMBL5866958 0.85 FGFR1 (0.36) GAAAAK1PRMT3SMN1; SMN2MAPT
SCHEMBL5750018 0.84 POLB (0.47) EPHX1POLBGAANPC1RAB9A
SCHEMBL5748810 0.84 NPC1 (0.50) EPHX1POLBGAANPC1RAB9A
SCHEMBL5746140 0.82 FGFR1 (0.48) PRMT3
SCHEMBL5749355 0.81 LMNA (0.49) EPHX1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL5750702 0.80 GAA (0.43) EPHX1POLBGAANPC1RAB9A
SCHEMBL5774197 0.80 FGFR1 (0.59)
SCHEMBL5749191 0.80 FGFR1 (0.53)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1372648-B1 TIE2 RECEPTOR KINASE INHIBITORS FOR TREATING ANGIOGENIC DISEASES SMITHKLINE BEECHAM CORP (US) 2006-03-15 EP disclosed
US-7005434-B2 Compounds and uses thereof SB CORPORATION (US) 2006-02-28 US disclosed
US-20040048888-A1 Novel compounds and uses thereof SMITHKLINE BEECHAM CORPORATION 2004-03-11 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-20040048888-A1 Novel compounds and uses thereof TEK, TIE1, KDR EPHX1 628/4885POLB 3228/4885GAA 1568/4885

“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.