SCHEMBL4135559

SCHEMBL4135559

O=C(O)c1ccc2c(c1)nc(-c1ccc3nc(C(=O)Nc4ccc(Cl)cc4)ccc3c1)n2C1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.51
NR1H4 Q96RI1 15/20 0.49
CYP3A4 P08684 5/20 0.49
CYP2C9 P11712 5/20 0.49
CYP2D6 P10635 4/20 0.49
KCNH2 Q12809 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
PRSS12 P56730 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
SCHEMBL4137916 0.89 MAPT (0.46) L3MBTL1NR1H4CYP3A4CYP2C9CYP2D6
SCHEMBL4122881 0.89 L3MBTL1 (0.48) L3MBTL1NR1H4CYP3A4CYP2C9CYP2D6
SCHEMBL14382796 0.88 L3MBTL1 (0.55) L3MBTL1NR1H4CYP3A4CYP2C9CYP2D6
SCHEMBL5519207 0.88 L3MBTL1 (0.55) L3MBTL1NR1H4CYP3A4CYP2C9CYP2D6
SCHEMBL4505559 0.87 L3MBTL1 (0.49) L3MBTL1NR1H4CYP3A4CYP2C9CYP2D6
SCHEMBL4119939 0.87 L3MBTL1 (0.47) L3MBTL1NR1H4CYP3A4CYP2C9CYP2D6
SCHEMBL4133794 0.87 L3MBTL1 (0.61) L3MBTL1NR1H4
SCHEMBL14383190 0.85 L3MBTL1 (0.53) L3MBTL1NR1H4CYP3A4CYP2C9CYP2D6
SCHEMBL4122876 0.85 L3MBTL1 (0.52) L3MBTL1NR1H4CYP3A4CYP2C9CYP2D6
SCHEMBL4119941 0.85 L3MBTL1 (0.48) L3MBTL1NR1H4CYP3A4CYP2C9CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050187390-A1 Bicyclic heteroaryl derivatives GENELABS TECHNOLOGIES, INC. 2005-08-25 US claimed
US-7511145-B2 Bicyclic heteroaryl derivatives GENELABS TECHNOLOGIES, INC. (US) 2009-03-31 US disclosed
US-7511145-B2 Bicyclic heteroaryl derivatives GENELABS TECHNOLOGIES, INC. (US) 2009-03-31 US disclosed
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
US-20090081165-A1 BICYCLIC HETEROARYL DERIVATIVES GENELABS TECHNOLOGIES, INC. 2009-03-26 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 L3MBTL1 1221/4885NR1H4 774/4885CYP3A4 52/4885
US-20050187390-A1 Bicyclic heteroaryl derivatives HAVCR2, MAVS, ZC3HAV1 L3MBTL1 1221/4885NR1H4 774/4885CYP3A4 52/4885

“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.