SCHEMBL1160734

SCHEMBL1160734

Cc1ccc(C(=O)NCc2cc(-c3ccc(C(=N)N(C)C)cc3)on2)s1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.42
EPHX2 P34913 3/20 0.41
POLB P06746 2/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.39
MAPT P10636 1/20 0.38
ROCK2 O75116 2/20 0.38
PRKCA P17252 1/20 0.38
GRK2 P25098 1/20 0.38
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL1097145 0.89 HPGD (0.45) EPHX2KMT2ANPC1RAB9ALMNA
SCHEMBL1158073 0.80 KMT2A (0.40) MIFPOLBKMT2ATDP1NPC1
SCHEMBL10313023 0.74 MIF (0.48) MIFPOLBKMT2ATDP1NPC1
SCHEMBL1095509 0.73 POLB (0.50) POLBSMN1; SMN2HTTMAPTLMNA
SCHEMBL10313024 0.73 MIF (0.56) MIFPOLBKMT2ATDP1NPC1
SCHEMBL1096846 0.72 F10 (0.53) KMT2AMAPTLMNATP53
SCHEMBL8279924 0.72 MAPK1 (0.43) KMT2ANPC1RAB9ALMNA
SCHEMBL1097716 0.71 MAPT (0.51) KMT2ANPC1RAB9AMAPTLMNA
SCHEMBL13886865 0.71 MIF (0.50) MIFPOLBKMT2ATDP1NPC1
SCHEMBL1096827 0.71 HPGD (0.46) POLBNPC1RAB9ASMN1; SMN2LMNA

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-8153670-B2 Factor Xa inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-04-10 US disclosed
US-20090298806-A1 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2009-12-03 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-20090298806-A1 FACTOR XA INHIBITORS TFPI, F12, F11 MIF 997/4885EPHX2 497/4885POLB 3172/4885

“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.