SCHEMBL19836644

SCHEMBL19836644

N#Cc1cnc(Nc2ccc(OC3CC(O)C3)c(Cl)c2)nc1N

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ MAPT P10636 1/20 0.45
▸ TBK1 Q9UHD2 7/20 0.40
▸ SYK P43405 1/20 0.38
▸ AURKA O14965 1/20 0.38
▸ EGFR P00533 3/20 0.37
▸ STK17B O94768 1/20 0.37
▸ STK17A Q9UEE5 1/20 0.37
▸ IKBKE Q14164 2/20 0.36
▸ CSNK1A1 P48729 1/20 0.36
▸ CLK4 Q9HAZ1 1/20 0.36
▸ KDR P35968 1/20 0.36
▸ ERBB2 P04626 3/20 0.36
▸ SRC P12931 1/20 0.36

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
SCHEMBL18995012 0.85 BCL6 (0.43) SYKEGFRSTK17BSTK17A
SCHEMBL18995121 0.82 NPC1 (0.47) NPC1RAB9AMAPTTBK1IKBKE
SCHEMBL19836643 0.75 EGFR (0.41) TBK1SYKEGFRERBB2
SCHEMBL18995069 0.73 ULK1 (0.44) SYKAURKASTK17BSTK17AKDR
SCHEMBL19527748 0.73 TBK1 (0.37) NPC1RAB9ATBK1SYKEGFR
SCHEMBL19527725 0.73 TNIK (0.39) MAPTTBK1SYKAURKAEGFR
SCHEMBL6222695 0.70 NPC1 (0.60) NPC1RAB9AMAPTSYKEGFR
SCHEMBL18995059 0.69 EGFR (0.41) SYKEGFRSTK17BSTK17AERBB2
SCHEMBL2447886 0.67 NPC1 (0.74) NPC1RAB9AMAPTSYKAURKA
SCHEMBL18995005 0.67 BCL6 (0.41) SYKAURKAEGFRSTK17BSTK17A

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 NPC1 1483/4885RAB9A 1427/4885MAPT 2530/4885
US-20180030050-A1 Protein Kinase C Inhibitors and Uses Thereof PRKCH, PRKCA, PRKCB NPC1 1483/4885RAB9A 1427/4885MAPT 2530/4885

“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.

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