SCHEMBL2007932

SCHEMBL2007932

CC(C)(C)c1ccc2cc(C(=O)NCc3cn[nH]c3)ccc2c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 10/20 0.51
NR1H4 Q96RI1 9/20 0.51
RAB9A P51151 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
NPC1 O15118 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
NAMPT P43490 2/20 0.50
ROCK2 O75116 1/20 0.50
LMNA P02545 2/20 0.49
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
HTT P42858 1/20 0.49
HDAC3 O15379 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL20671969 0.79 NAMPT (0.52) EPHX2NR1H4RAB9AMEN1KMT2A
SCHEMBL2909521 0.79 LMNA (0.55) EPHX2NR1H4RAB9AMEN1KMT2A
SCHEMBL1842237 0.78 ROCK2 (0.52) EPHX2NR1H4RAB9AMEN1KMT2A
SCHEMBL18617523 0.77 NAMPT (0.57) NAMPTROCK2LMNAALDH1A1
SCHEMBL2909920 0.76 NR1H4 (0.54) EPHX2NR1H4RAB9AMEN1KMT2A
SCHEMBL5406054 0.74 MAOB (0.67) EPHX2NR1H4RAB9AMEN1KMT2A
SCHEMBL2906747 0.74 EPHX2 (0.51) EPHX2NR1H4RAB9AMEN1KMT2A
SCHEMBL1839844 0.74 EPHX2 (0.45) EPHX2NR1H4RAB9AMEN1KMT2A
SCHEMBL1841616 0.73 ROCK2 (0.52) EPHX2NR1H4RAB9AMEN1KMT2A
SCHEMBL263881 0.73 NR1H4 (0.47) EPHX2NR1H4RAB9AMEN1KMT2A

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-7964732-B2 Substituted bicyclocarboxyamide compounds PFIZER INC. (US) 2011-06-21 US disclosed
US-20100267769-A1 Substituted Bicyclocarboxyamide Compounds Pfizer, Inc. and Renovis Inc. 2010-10-21 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-20100267769-A1 Substituted Bicyclocarboxyamide Compounds TRPV1, OPRL1, CNR1 EPHX2 2999/4885NR1H4 330/4885RAB9A 2103/4885

“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.