SCHEMBL3767587

SCHEMBL3767587

COc1ncc(-c2cccc(-n3cnc4cc([C@@H](C)N)ccc43)c2)c(OC)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 1/20 0.42
QPCTL Q9NXS2 1/20 0.42
FGFR1 P11362 7/20 0.39
KDR P35968 1/20 0.39
PTGES2 Q9H7Z7 1/20 0.39
GABRA1 P14867 3/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
GABRA5 P31644 2/20 0.38
GABRA3 P34903 2/20 0.38
P2RX3 P56373 1/20 0.37
HPGD P15428 3/20 0.37
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GABRA2 P47869 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL2651887 1.00 QPCT (0.42) QPCTQPCTLFGFR1KDRPTGES2
SCHEMBL3773339 1.00 QPCT (0.42) QPCTQPCTLFGFR1KDRPTGES2
SCHEMBL1761983 0.91 QPCT (0.42) QPCTQPCTLFGFR1KDRPTGES2
SCHEMBL1761998 0.91 QPCT (0.42) QPCTQPCTLFGFR1KDRPTGES2
SCHEMBL2652381 0.86 QPCT (0.39) QPCTQPCTLFGFR1KDRPTGES2
SCHEMBL2659323 0.86 QPCT (0.39) QPCTQPCTLFGFR1KDRPTGES2
SCHEMBL3767093 0.86 QPCT (0.39) QPCTQPCTLFGFR1KDRPTGES2
SCHEMBL2656109 0.84 FGFR1 (0.38) QPCTQPCTLFGFR1HPGDALDH1A1
SCHEMBL2651393 0.83 GABRA1 (0.49) FGFR1KDRPTGES2GABRA1GABRG2
SCHEMBL2652767 0.83 GABRA1 (0.49) FGFR1KDRPTGES2GABRA1GABRG2

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-7851490-B2 Benzimidazole derivatives and their use for modulating the GABAA receptor complex NEUROSEARCH A/S (DK) 2010-12-14 US disclosed
US-20090036493-A1 Benzimidazole Derivatives and Their Use for Modulating the GABA Alpha Receptor Complex ANIONA APS (DK) 2009-02-05 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-20090036493-A1 Benzimidazole Derivatives and Their Use for Modulating the GABA Alpha Receptor Complex GABRB2, GABRB1, GABRB3 QPCT 1489/4885QPCTL 3217/4885FGFR1 3912/4885

“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.