SCHEMBL9105880

SCHEMBL9105880

Cc1ccc(C)c(CC(=O)N2CCC(c3nc(C(N)=O)cs3)CC2)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SPR P35270 2/20 0.42
FAAH O00519 3/20 0.40
LMNA P02545 3/20 0.37
HTT P42858 2/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TRPC3 Q13507 2/20 0.37
TRPC6 Q9Y210 2/20 0.37
UBE2M P61081 2/20 0.35
DCUN1D1 Q96GG9 2/20 0.35
POLB P06746 2/20 0.35
ALDH1A1 P00352 1/20 0.35
ALOX12 P18054 1/20 0.35
PPARG P37231 1/20 0.35
MAPT P10636 2/20 0.35
TP53 P04637 2/20 0.35

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
SCHEMBL1228585 0.91 FAAH (0.42) FAAHLMNAHTTMEN1USP2
SCHEMBL27863492 0.88 NPC1 (0.40) FAAHLMNAHTTMEN1USP2
SCHEMBL1227008 0.88 FAAH (0.41) FAAHLMNAHTTMEN1USP2
SCHEMBL9109184 0.88 SPR (0.44) SPRMEN1KMT2A
SCHEMBL1228591 0.87 FAAH (0.42) FAAHLMNAHTTMEN1KMT2A
Hydrochloric Acid SCHEMBL1227743 0.87 FAAH (0.41) FAAHLMNAHTTMEN1USP2
SCHEMBL29497684 0.84 FAAH (0.40) FAAHLMNAHTTMEN1USP2
SCHEMBL18978887 0.84 FAAH (0.40) FAAHLMNAHTTMEN1USP2
SCHEMBL2581288 0.80 FAAH (0.39) FAAHLMNAHTTMEN1USP2
SCHEMBL18978919 0.79 FAAH (0.43) FAAHLMNAHTTMEN1USP2

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-8557821-B2 Microbiocidal heterocycles SYNGENTA CROP PROTECTION, LLC (US) 2013-10-15 US disclosed
US-20120142700-A1 MICROBIOCIDAL HETEROCYCLES SYNGENTA CROP PROTECTION, LLC (US) 2012-06-07 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-20120142700-A1 MICROBIOCIDAL HETEROCYCLES MPO, CYP51A1, CYP1A1 SPR 1673/4885FAAH 275/4885LMNA 3533/4885

“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.