SCHEMBL10189706

SCHEMBL10189706

COc1cc(-c2nn[nH]c2-c2ccc(-c3ccccn3)cc2)cc(C)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.41
KDM4E B2RXH2 3/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
DCTPP1 Q9H773 1/20 0.39
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 2/20 0.38
MAPT P10636 1/20 0.38
TGFBR1 P36897 2/20 0.38
ATM Q13315 1/20 0.38
HPGD P15428 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
GAA P10253 1/20 0.37
CREBBP Q92793 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GUSB P08236 1/20 0.35
RAF1 P04049 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP19A1 P11511 1/20 0.34

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
SCHEMBL410554 0.87 ALDH1A1 (0.51) ERN1KDM4EALDH1A1NPC1MAPT
SCHEMBL10189705 0.82 S1PR1 (0.38) ERN1NPC1MAPTSMN1; SMN2CCNB2
SCHEMBL10189728 0.82 SMPD3 (0.41) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL10189699 0.82 ALDH1A1 (0.35) KDM4EALDH1A1IDO1PDE4ACCNB2
SCHEMBL10189708 0.82 S1PR1 (0.37) ERN1ALDH1A1NPC1MAPTHSD17B10
SCHEMBL10189703 0.81 SMPD3 (0.41) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL10189702 0.81 CHEK1 (0.38) KDM4EMEN1KMT2AALDH1A1HSD17B10
SCHEMBL10189707 0.81 PDGFRB (0.41) KDM4EMEN1KMT2AALDH1A1NPC1
SCHEMBL10189704 0.80 MAPK1 (0.43) ERN1KDM4ENPC1MAPTL3MBTL1
SCHEMBL10189749 0.79 TEK (0.34) ALDH1A1CYP1A2IDO1CCNB2CDK1

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-9175022-B2 Compounds for the treatment of proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2015-11-03 US disclosed
US-8501790-B2 Compounds for the treatment of proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2013-08-06 US disclosed
US-20120022118-A1 COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. 2012-01-26 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-20120022118-A1 COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS RB1, MKI67, MAPRE1 ERN1 3240/4885KDM4E 2492/4885MEN1 1571/4885

“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.