SCHEMBL4758602

SCHEMBL4758602

COc1cc(C)cc2nccc(Cl)c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 3/20 0.43
CGAS Q8N884 1/20 0.41
MAPT P10636 5/20 0.41
HPGD P15428 5/20 0.41
L3MBTL1 Q9Y468 5/20 0.41
MAPK1 P28482 3/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
ALOX12 P18054 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
DOT1L Q8TEK3 1/20 0.39
DYRK1A Q13627 1/20 0.39
ACHE P22303 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38

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
SCHEMBL30509466 0.83 SRC (0.51) SRCCGASMAPTHPGDMAPK1
SCHEMBL2210144 0.83 SRC (0.51) SRCCGASMAPTHPGDMAPK1
SCHEMBL6468054 0.79 ALDH1A1 (0.36) MAPTMEN1ALDH1A1KMT2ANPSR1
SCHEMBL11729820 0.76 TGFBR1 (0.48) SRCHPGDALDH1A1DOT1L
SCHEMBL24008989 0.72 SRC (0.58) SRCCGASDOT1LDYRK1APDGFRB
SCHEMBL6004164 0.72 CGAS (0.59) SRCCGASDOT1LDYRK1APDGFRB
SCHEMBL21249080 0.71 EGFR (0.53)
SCHEMBL29576504 0.70 SRC (0.60) SRCCGASPDGFRBPDGFRA
SCHEMBL29387468 0.70 SRC (0.60) SRCCGASPDGFRBPDGFRA
SCHEMBL359988 0.70 SRC (0.60) SRCCGASPDGFRBPDGFRA

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-20140336182-A1 Aurora Kinase Modulators and Method of Use AMGEN INC (US) 2014-11-13 US disclosed
US-8557816-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2013-10-15 US disclosed
US-20120122847-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2012-05-17 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-20140336182-A1 Aurora Kinase Modulators and Method of Use AURKC, AURKA, CDK1 SRC 447/4885CGAS 2486/4885MAPT 1693/4885
US-20120122847-A1 AURORA KINASE MODULATORS AND METHOD OF USE AURKC, AURKA, CDK1 SRC 447/4885CGAS 2486/4885MAPT 1693/4885

“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.