SCHEMBL1359693

SCHEMBL1359693

Cc1ccc(S(=O)(=O)Oc2cc(C)c(NC(=O)c3cccc(NC(=O)c4ccccc4)c3)c(Br)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.53
GPR17 Q13304 7/20 0.50
ENPP1 P22413 2/20 0.48
ENPP3 O14638 1/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
ALDH1A1 P00352 3/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
HPGD P15428 1/20 0.48
P2RY2 P41231 3/20 0.47
MAPT P10636 3/20 0.47
POLB P06746 2/20 0.47
LMNA P02545 2/20 0.47
KCNK9 Q9NPC2 3/20 0.47
KCNK3 O14649 2/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
NLRP3 Q96P20 1/20 0.46
ATM Q13315 1/20 0.45

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
SCHEMBL1361555 0.85 KCNK3 (0.49) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL1361514 0.77 KMT2A (0.56) MEN1KMT2APOLBKCNK9KCNK3
SCHEMBL22446523 0.71 GPR17 (0.70) ENPP2GPR17ENPP1ENPP3MEN1
SCHEMBL22187158 0.71 GPR17 (0.54) ENPP2GPR17MEN1KMT2AALDH1A1
SCHEMBL21753701 0.71 GPR17 (0.56) ENPP2GPR17ENPP1ENPP3MEN1
SCHEMBL31058590 0.71 GPR17 (0.56) ENPP2GPR17ENPP1ENPP3MEN1
SCHEMBL30540135 0.71 GPR17 (0.54) ENPP2GPR17MEN1KMT2AALDH1A1
SCHEMBL27886604 0.71 TSHR (0.39) MEN1KMT2AALDH1A1LMNAKCNK9
SCHEMBL13875615 0.70 KCNK3 (0.50) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL22187488 0.69 GPR17 (0.57) ENPP2GPR17ENPP1ENPP3MEN1

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
US-8067638-B2 Amide derivative and insecticide containing the same MITSUI CHEMICALS, INC. (JP) 2011-11-29 US disclosed
US-20090233962-A1 Amide derivative and insecticide containing the same MITSUI CHEMICALS, INC. (JP) 2009-09-17 US disclosed
EP-1911751-A1 AMIDE DERIVATIVE AND PESTICIDE CONTAINING SUCH COMPOUND Mitsui Chemicals, Inc. (JP) 2008-04-16 EP 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-20090233962-A1 Amide derivative and insecticide containing the same CYP1A1, CYP4B1, CYP2E1 ENPP2 3370/4885GPR17 4755/4885ENPP1 4252/4885

“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.