SCHEMBL4123088

SCHEMBL4123088

O=C(O)c1ccc2c(c1)nc(-c1ccc3nc(-c4ccccc4)cc(Nc4ccc(Cl)cc4)c3c1)n2C1CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.48
NR1H4 Q96RI1 9/20 0.44
MAPKAPK2 P49137 1/20 0.43
CYP2C9 P11712 5/20 0.42
CYP3A4 P08684 4/20 0.42
CYP2D6 P10635 4/20 0.42
PTGER4 P35408 4/20 0.42
ACP1 P24666 1/20 0.41
KCNH2 Q12809 2/20 0.40
HDAC1 Q13547 3/20 0.40
HDAC6 Q9UBN7 3/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC3 O15379 2/20 0.40
HDAC10 Q969S8 2/20 0.40

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
SCHEMBL4117284 0.94 L3MBTL1 (0.52) L3MBTL1PTGER4HDAC1HDAC6HDAC8
SCHEMBL4126129 0.87 L3MBTL1 (0.52) L3MBTL1PTGER4HDAC1HDAC6HDAC8
SCHEMBL4129617 0.83 L3MBTL1 (0.59) L3MBTL1PTGER4HDAC1HDAC6HDAC8
SCHEMBL4129638 0.83 L3MBTL1 (0.48) L3MBTL1PTGER4ACP1
SCHEMBL13904683 0.81 L3MBTL1 (0.52) L3MBTL1NR1H4CYP2C9PTGER4KCNH2
SCHEMBL4122230 0.80 L3MBTL1 (0.52) L3MBTL1PTGER4HDAC1HDAC6HDAC8
SCHEMBL4133824 0.80 L3MBTL1 (0.55) L3MBTL1PTGER4HDAC1HDAC6HDAC8
SCHEMBL27553684 0.80 L3MBTL1 (0.60) L3MBTL1PTGER4HDAC1HDAC6HDAC8
SCHEMBL4135862 0.80 OPRM1 (0.48) L3MBTL1PTGER4ACP1
SCHEMBL14382768 0.80 L3MBTL1 (0.65) L3MBTL1NR1H4CYP2C9CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2007501189-A 2007-01-25 JP claimed
EP-1651631-A1 BICYCLIC IMIDAZOL DERIVATIVES AGAINST FLAVIVIRIDAE GENELABS TECHNOLOGIES, INC. (US) 2006-05-03 EP claimed
US-20050187390-A1 Bicyclic heteroaryl derivatives GENELABS TECHNOLOGIES, INC. 2005-08-25 US claimed
WO-2005012288-A1 BICYCLIC IMIDAZOL DERIVATIVES AGAINST FLAVIVIRIDAE GENELABS TECHNOLOGIES, INC (US) 2005-02-10 WO 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
US-20050187390-A1 Bicyclic heteroaryl derivatives GENELABS TECHNOLOGIES, INC. 2005-08-25 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 (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 774/4885MAPKAPK2 4378/4885
US-20050187390-A1 Bicyclic heteroaryl derivatives HAVCR2, MAVS, ZC3HAV1 L3MBTL1 1221/4885NR1H4 774/4885MAPKAPK2 4378/4885

“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.