SCHEMBL2968148

SCHEMBL2968148

COC(c1cccc(-n2cnc3cc(/C=N/O)ccc32)c1)c1nccs1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.40
HPGD P15428 2/20 0.37
FGFR1 P11362 8/20 0.35
PRKDC P78527 1/20 0.34
CTSA P10619 4/20 0.34
KDR P35968 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33

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
SCHEMBL2651746 0.84 FGFR1 (0.39) HPGDFGFR1KDR
SCHEMBL2653470 0.84 GABRA1 (0.43) HPGDFGFR1KDRGABRA1GABRG2
SCHEMBL2978010 0.83 ALOX5 (0.48) ALOX5HPGDFGFR1PRKDCCTSA
SCHEMBL2652694 0.82 HPGD (0.37) HPGDFGFR1KDRGABRA1GABRG2
SCHEMBL2970282 0.82 FGFR1 (0.38) HPGDFGFR1KDR
SCHEMBL2977538 0.82 HPGD (0.37) HPGDFGFR1KDRGABRA1GABRG2
SCHEMBL2968478 0.81 ALOX5 (0.48) ALOX5HPGDFGFR1PRKDCKDR
SCHEMBL2963280 0.80 HPGD (0.37) HPGDFGFR1KDR
SCHEMBL2977437 0.78 FGFR1 (0.48) ALOX5HPGDFGFR1GABRA1GABRG2
SCHEMBL2643152 0.77 GABRA1 (0.38) FGFR1GABRA1GABRG2GABRB3GABRA5

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-7776900-B2 Benzimidazole derivatives and their use for modulating the GABAAreceptor complex NEUROSEARCH A/S (DK) 2010-08-17 US claimed
US-20090030018-A1 Benzimidazole derivatives and their use for modulating the gabaalpha receptor complex ANIONA APS (DK) 2009-01-29 US claimed
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

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 ALOX5 3303/4885HPGD 1855/4885FGFR1 4324/4885

“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.