SCHEMBL4835312

SCHEMBL4835312

COc1ccc2c(c1)/C(=C/C(=O)c1ccc(NC(=O)c3ccc(F)cc3)cc1)NC(C)(C)C2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.44
NPC1 O15118 6/20 0.43
RAB9A P51151 6/20 0.43
TP53 P04637 4/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
ALOX15 P16050 1/20 0.43
NFE2L2 Q16236 1/20 0.43
ATM Q13315 1/20 0.42
ALDH1A1 P00352 3/20 0.42
MAPT P10636 3/20 0.42
HPGD P15428 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 4/20 0.41
PKM P14618 1/20 0.41
GPR35 Q9HC97 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
GLA P06280 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP1A2 P05177 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
SCHEMBL4835328 1.00 KMT2A (0.44) KMT2ANPC1RAB9ATP53SMN1; SMN2
SCHEMBL4839102 0.94 RAB9A (0.49) KMT2ANPC1RAB9ATP53SMN1; SMN2
SCHEMBL4839109 0.94 RAB9A (0.49) KMT2ANPC1RAB9ATP53SMN1; SMN2
SCHEMBL4844449 0.92 KMT2A (0.47) KMT2ANPC1RAB9ATP53SMN1; SMN2
SCHEMBL4840822 0.92 NPC1 (0.49) KMT2ANPC1RAB9ATP53SMN1; SMN2
SCHEMBL4840832 0.92 NPC1 (0.49) KMT2ANPC1RAB9ATP53SMN1; SMN2
SCHEMBL4835233 0.92 NPC1 (0.51) KMT2ANPC1RAB9ATP53SMN1; SMN2
SCHEMBL4835216 0.92 NPC1 (0.51) KMT2ANPC1RAB9ATP53SMN1; SMN2
SCHEMBL4837859 0.92 AR (0.44) KMT2ANPC1RAB9ATP53SMN1; SMN2
SCHEMBL4844437 0.92 KMT2A (0.47) KMT2ANPC1RAB9ATP53SMN1; SMN2

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-7378428-B2 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-27 US disclosed
US-20050222138-A1 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-10-06 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-20050222138-A1 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient PARK7, MMP8, CDK7 KMT2A 4642/4885NPC1 985/4885RAB9A 2220/4885

“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.