SCHEMBL2652990

SCHEMBL2652990

CCOC(=O)c1ccc2c(c1)ncn2-c1cccc(CO)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 4/20 0.57
HPGD P15428 8/20 0.56
KMT2A Q03164 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.50
MAPK1 P28482 1/20 0.50
NPC1 O15118 2/20 0.49
ALDH1A1 P00352 1/20 0.49
GLA P06280 1/20 0.49
RAB9A P51151 1/20 0.49
SIRT2 Q8IXJ6 1/20 0.49
SIRT1 Q96EB6 1/20 0.49
GABRA1 P14867 1/20 0.48
GABRG2 P18507 1/20 0.48
GABRB3 P28472 1/20 0.48
GABRA5 P31644 1/20 0.48
GABRA3 P34903 1/20 0.48
GABRA2 P47869 1/20 0.48
TP53 P04637 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MEN1 O00255 1/20 0.47

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
SCHEMBL2668059 0.87 HPGD (0.51) FGFR1HPGDKMT2ASMN1; SMN2MAPK1
SCHEMBL30343744 0.86 FGFR1 (0.75) FGFR1HPGDSMN1; SMN2NPC1ALDH1A1
SCHEMBL13202768 0.86 HPGD (0.51) FGFR1HPGDKMT2ASMN1; SMN2MAPK1
SCHEMBL2648217 0.86 FGFR1 (0.65) FGFR1HPGDKMT2ASMN1; SMN2MAPK1
SCHEMBL2652605 0.84 FGFR1 (0.52) FGFR1HPGDKMT2ASMN1; SMN2MAPK1
SCHEMBL2652993 0.83 GABRA1 (0.54) FGFR1HPGDKMT2ASMN1; SMN2MAPK1
SCHEMBL2651905 0.83 TP53 (0.50) FGFR1HPGDKMT2ASMN1; SMN2MAPK1
SCHEMBL2651812 0.83 FGFR1 (0.50) FGFR1HPGDKMT2ASMN1; SMN2MAPK1
SCHEMBL2652038 0.83 KMT2A (0.52) FGFR1HPGDKMT2ASMN1; SMN2MAPK1
SCHEMBL2652329 0.83 GABRA1 (0.54) FGFR1HPGDKMT2ASMN1; SMN2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7776900-B2 Benzimidazole derivatives and their use for modulating the GABAAreceptor complex NEUROSEARCH A/S (DK) 2010-08-17 US disclosed
US-7776900-B2 Benzimidazole derivatives and their use for modulating the GABAAreceptor complex NEUROSEARCH A/S (DK) 2010-08-17 US disclosed
US-7776900-B2 Benzimidazole derivatives and their use for modulating the GABAAreceptor complex NEUROSEARCH A/S (DK) 2010-08-17 US disclosed
US-20090030018-A1 Benzimidazole derivatives and their use for modulating the gabaalpha receptor complex ANIONA APS (DK) 2009-01-29 US disclosed
US-20090030018-A1 Benzimidazole derivatives and their use for modulating the gabaalpha receptor complex ANIONA APS (DK) 2009-01-29 US disclosed
US-20090030018-A1 Benzimidazole derivatives and their use for modulating the gabaalpha receptor complex ANIONA APS (DK) 2009-01-29 US disclosed
EP-1874758-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABAA RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 2008-01-09 EP disclosed
WO-2006111516-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABAA RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 2006-10-26 WO 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-20090030018-A1 Benzimidazole derivatives and their use for modulating the gabaalpha receptor complex GABRB2, GABRB1, GABRB3 FGFR1 4324/4885HPGD 1855/4885KMT2A 2084/4885

“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.