SCHEMBL4117448

SCHEMBL4117448

CC(=O)c1ccc2c(c1)c1cc(Cl)ccc1n2C

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.51
BAZ2B Q9UIF8 1/20 0.47
GABRA1 P14867 1/20 0.46
GABRG2 P18507 1/20 0.46
GABRB3 P28472 1/20 0.46
GABRA5 P31644 1/20 0.46
KCNH2 Q12809 1/20 0.46
ALDH1A1 P00352 3/20 0.44
HPGD P15428 2/20 0.44
OXER1 Q8TDS5 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 3/20 0.42
HSD17B10 Q99714 1/20 0.42
PTGS2 P35354 2/20 0.42
EGFR P00533 1/20 0.42
PKM P14618 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL28121877 0.89 KDM4E (0.61) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL16120103 0.83 HPGD (0.57) KDM4EALDH1A1HPGDMAPT
SCHEMBL1921296 0.82 KDM4E (0.53) KDM4EBAZ2BKCNH2ALDH1A1HPGD
SCHEMBL2026269 0.81 KDM4E (0.76) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL15829743 0.81 KDM4E (0.53) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL11013382 0.78 PTGS2 (0.53) ALDH1A1HPGDPTGS2
SCHEMBL9979911 0.78 KDM4E (0.50) KDM4EBAZ2BKCNH2ALDH1A1HPGD
SCHEMBL1336873 0.77 GABRA1 (0.42) KDM4EGABRA1GABRG2GABRB3GABRA5
SCHEMBL24067320 0.77 EGFR (0.51) BAZ2BGABRA1GABRG2GABRB3GABRA5
SCHEMBL1339005 0.76 ALDH1A1 (0.42) KDM4EGABRA1GABRG2GABRB3GABRA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7511145-B2 Bicyclic heteroaryl derivatives GENELABS TECHNOLOGIES, INC. (US) 2009-03-31 US disclosed
US-20090081165-A1 BICYCLIC HETEROARYL DERIVATIVES GENELABS TECHNOLOGIES, INC. 2009-03-26 US disclosed
EP-1651631-A1 BICYCLIC IMIDAZOL DERIVATIVES AGAINST FLAVIVIRIDAE GENELABS TECHNOLOGIES, INC. (US) 2006-05-03 EP disclosed
US-20050187390-A1 Bicyclic heteroaryl derivatives GENELABS TECHNOLOGIES, INC. 2005-08-25 US disclosed
WO-2005012288-A1 BICYCLIC IMIDAZOL DERIVATIVES AGAINST FLAVIVIRIDAE GENELABS TECHNOLOGIES, INC (US) 2005-02-10 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 (2 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-20090081165-A1 BICYCLIC HETEROARYL DERIVATIVES HAVCR2, MAVS, ZC3HAV1 KDM4E 2491/4885BAZ2B 62/4885GABRA1 1428/4885
US-20050187390-A1 Bicyclic heteroaryl derivatives HAVCR2, MAVS, ZC3HAV1 KDM4E 2491/4885BAZ2B 62/4885GABRA1 1428/4885

“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.