SCHEMBL4510396

SCHEMBL4510396

Cc1oncc1C(=O)Nc1c(C#N)oc2ccc(Br)cc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.42
NPC1 O15118 5/20 0.42
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
KDM4E B2RXH2 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
DHODH Q02127 2/20 0.40
LMNA P02545 2/20 0.40
GMNN O75496 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
HTR1A P08908 1/20 0.40
THRB P10828 1/20 0.40
PIM1 P11309 1/20 0.40
CYP2C9 P11712 1/20 0.40
MAOA P21397 1/20 0.40

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
SCHEMBL4504982 0.85 RAB9A (0.48) RAB9ANPC1ALDH1A1HPGDKDM4E
SCHEMBL4492603 0.83 ALDH1A1 (0.50) RAB9ANPC1ALDH1A1HPGDKDM4E
SCHEMBL4503918 0.83 MAPT (0.49) RAB9ANPC1ALDH1A1HPGDKDM4E
SCHEMBL4509404 0.81 RAB9A (0.42) RAB9ANPC1ALDH1A1HPGDKDM4E
SCHEMBL4493038 0.79 ALDH1A1 (0.56) ALDH1A1HPGDKDM4EKMT2AMEN1
SCHEMBL4494971 0.77 MAPT (0.52) RAB9ANPC1ALDH1A1HPGDKDM4E
SCHEMBL4504465 0.76 DHODH (0.44) RAB9ANPC1ALDH1A1HPGDKDM4E
SCHEMBL13600984 0.76 ALDH1A1 (0.50) RAB9ANPC1ALDH1A1HPGDKDM4E
SCHEMBL13102912 0.75 KMT2A (0.46) RAB9ANPC1ALDH1A1HPGDKDM4E
SCHEMBL13600994 0.74 MAPT (0.60) RAB9ANPC1ALDH1A1HPGDKDM4E

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-7638540-B2 Benzofuran compound and medicinal composition containing the same THE NEW INDUSTRY RESEARCH ORGANIZATION (JP) 2009-12-29 US disclosed
US-7638540-B2 Benzofuran compound and medicinal composition containing the same THE NEW INDUSTRY RESEARCH ORGANIZATION (JP) 2009-12-29 US disclosed
US-20060194851-A1 Benzofuran compound and medicinal composition containing the same NEW INDUSTRY RESEARCH ORGANIZATION, THE (JP) 2006-08-31 US disclosed
EP-1627873-A1 BENZOFURAN COMPOUND AND MEDICINAL COMPOSITION CONTAINING THE SAME The New Industry Research Organization (JP) 2006-02-22 EP 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-20060194851-A1 Benzofuran compound and medicinal composition containing the same LTB4R2, LTC4S, LTB4R RAB9A 4698/4885NPC1 1377/4885ALDH1A1 658/4885

“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.