SCHEMBL19836631

SCHEMBL19836631

CCCc1ccc(C)c(-n2nn[nH]c2=O)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 3/20 0.34
MGLL Q99685 1/20 0.33
ADAMTS5 Q9UNA0 1/20 0.32
CNR2 P34972 2/20 0.32
MAPT P10636 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
GFER P55789 1/20 0.32
CNR1 P21554 1/20 0.32
ADRA1D P25100 1/20 0.32
ADRA1A P35348 1/20 0.32
ADRA1B P35368 1/20 0.32
GPR84 Q9NQS5 2/20 0.31
RPS6KB1 P23443 1/20 0.31
MGAT2 Q10469 1/20 0.31
MOGAT2 Q3SYC2 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31

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
SCHEMBL8977290 0.79 HSD17B10 (0.50) CNR2NPC1RAB9AKMT2ALMNA
SCHEMBL15352559 0.77 HTR7 (0.39) ADAMTS5MAPTLMNATP53
SCHEMBL8599342 0.76 SLC5A1 (0.39) SLC5A1MGLL
SCHEMBL5906376 0.72 ALDH1A1 (0.44) MGLLMAPTRAB9AMEN1KMT2A
SCHEMBL8977342 0.70 NPSR1 (0.45) MAPTRAB9AGFERMEN1KMT2A
SCHEMBL8688702 0.69 PDE9A (0.39) MAPT
SCHEMBL16490930 0.69 KDM4E (0.35) NPC1RAB9A
SCHEMBL19886225 0.69 CA12 (0.41)
SCHEMBL16490975 0.69 KMT2A (0.32) SLC5A1MGLLKMT2ALMNA
SCHEMBL19836216 0.69 POLB (0.49) MEN1KMT2ALMNATP53

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-10005777-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2018-06-26 US disclosed
US-20180030050-A1 Protein Kinase C Inhibitors and Uses Thereof MIDCAP FINANCIAL TRUST 2018-02-01 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 (2 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-10005777-B2 Protein kinase C inhibitors and uses thereof PRKCH, PRKCA, PRKCB SLC5A1 4298/4885MGLL 2284/4885ADAMTS5 3603/4885
US-20180030050-A1 Protein Kinase C Inhibitors and Uses Thereof PRKCH, PRKCA, PRKCB SLC5A1 4298/4885MGLL 2284/4885ADAMTS5 3603/4885

“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.