SCHEMBL1704606

SCHEMBL1704606

COc1cc(NC(=O)c2ccc(C)c(-c3cnc4sc(N)nc4c3)c2)cc(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 3/20 0.49
CSF1R P07333 7/20 0.49
PLAU P00749 2/20 0.47
PLG P00747 1/20 0.45
MAPT P10636 2/20 0.45
MAPK14 Q16539 1/20 0.45
NPC1 O15118 3/20 0.45
RAB9A P51151 2/20 0.44
TP53 P04637 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
GAA P10253 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL10159643 0.84 TRPV1 (0.48) ABL1MAPTMAPK14NPC1RAB9A
SCHEMBL1705565 0.80 LCK (0.65) ABL1CSF1RMAPTMAPK14RAF1
SCHEMBL1696213 0.80 LDHA (0.41) MAPTMAPK14NPC1RAB9ATP53
SCHEMBL1705288 0.80 MAPK14 (0.57) MAPTMAPK14NPC1RAB9ATP53
SCHEMBL1705324 0.80 ABL1 (0.43) ABL1MAPTMAPK14NPC1RAB9A
SCHEMBL1704008 0.80 MAPK14 (0.44) ABL1MAPTMAPK14NPC1RAB9A
SCHEMBL1703715 0.78 DDR2 (0.54) ABL1CSF1RMAPTMAPK14NPC1
SCHEMBL1704882 0.77 MAPK14 (0.68) CSF1RMAPK14RAF1
SCHEMBL1705078 0.76 MAPK14 (0.49) MAPTMAPK14MEN1ALDH1A1KMT2A
SCHEMBL1703596 0.73 MAPK1 (0.59) ABL1MAPTMAPK14

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9505784-B2 Fused 2-aminothiazole compounds DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-11-29 US disclosed
US-20150094315-A1 FUSED 2-AMINOTHIAZOLE COMPOUNDS DANA-FARBER CANCER INSTITUTE, INC. (US) 2015-04-02 US disclosed
US-8765747-B2 Fused 2-aminothiazole compounds DANA-FARBER CANCER INSTITUTE, INC. (US) 2014-07-01 US disclosed
US-20120088766-A1 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USES DANA-FARBER CANCER INSTITUTE, INC. (US) 2012-04-12 US disclosed
WO-2010144909-A1 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2010-12-16 WO 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-20120088766-A1 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USES OAT, OTC, DLD ABL1 1023/4885CSF1R 4045/4885PLAU 1127/4885
US-20150094315-A1 FUSED 2-AMINOTHIAZOLE COMPOUNDS GOT2, OAT, ABAT ABL1 318/4885CSF1R 2669/4885PLAU 872/4885

“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.