SCHEMBL1390296

SCHEMBL1390296

CC(=O)NCCNC(=O)c1ccc(C(CC(=O)c2ccc(=O)n(C)c2)c2ccccc2C)cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 3/20 0.40
RAB9A P51151 3/20 0.40
MAPT P10636 2/20 0.40
EPHX2 P34913 2/20 0.39
BRD4 O60885 2/20 0.39
LMNA P02545 2/20 0.39
POLB P06746 1/20 0.39
SLC6A9 P48067 1/20 0.38
DGAT1 O75907 1/20 0.38
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
NPC1 O15118 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35
CREBBP Q92793 1/20 0.35
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
GCGR P47871 1/20 0.34

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
SCHEMBL1390430 0.91 EPHX2 (0.40) GPBAR1RAB9AEPHX2BRD4LMNA
SCHEMBL1390381 0.90 GCGR (0.43) GPBAR1EPHX2BRD4GCGR
SCHEMBL1389827 0.89 GPBAR1 (0.50) GPBAR1RAB9AMAPTEPHX2BRD4
SCHEMBL1389824 0.89 GPBAR1 (0.50) GPBAR1RAB9AMAPTEPHX2BRD4
SCHEMBL1389821 0.89 GPBAR1 (0.50) GPBAR1RAB9AMAPTEPHX2BRD4
SCHEMBL1390386 0.89 MAPK1 (0.40) GPBAR1RAB9AEPHX2BRD4LMNA
SCHEMBL1390429 0.88 SLC6A9 (0.43) GPBAR1MAPTEPHX2BRD4SLC6A9
SCHEMBL369714 0.88 EPHX2 (0.38) GPBAR1RAB9AEPHX2BRD4LMNA
SCHEMBL1390170 0.86 EPHX2 (0.42) GPBAR1RAB9AMAPTEPHX2BRD4
SCHEMBL1390189 0.86 LMNA (0.41) GPBAR1RAB9AMAPTEPHX2BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593426-B1 1-HYDROXYIMINO-3-PHENYL-PROPANES HOFFMANN LA ROCHE (CH) 2014-08-20 EP disclosed
US-8765730-B2 1-hydroxyimino-3-phenyl-propanes Hoffmann-La Roche Inc (US) 2014-07-01 US disclosed
US-20120010190-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-12 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-20120010190-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES GPBAR1, GPR119, ADRB1 GPBAR1 1/4885RAB9A 3549/4885MAPT 4149/4885

“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.