SCHEMBL10189700

SCHEMBL10189700

COc1ccc(-c2[nH]nnc2-c2cc(C)c(C)c(OC)c2)cc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.40
KDM4E B2RXH2 3/20 0.40
MAPK1 P28482 1/20 0.40
PDGFRB P09619 1/20 0.40
PDGFRA P16234 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CD274 Q9NZQ7 1/20 0.39
HTT P42858 2/20 0.38
TUBB1 Q9H4B7 1/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
CYP17A1 P05093 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PTGS1 P23219 1/20 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
SCHEMBL407740 0.87 KDM4E (0.45) ALDH1A1KDM4EMAPK1PDGFRBPDGFRA
SCHEMBL10189739 0.86 CCNB2 (0.36) ALDH1A1KDM4EMAPK1PDGFRBPDGFRA
SCHEMBL10189720 0.86 TUBB1 (0.44) ALDH1A1KDM4EMAPK1MEN1KMT2A
SCHEMBL10189742 0.86 CCNB2 (0.38) ALDH1A1MEN1KMT2ALMNA
SCHEMBL10189699 0.85 ALDH1A1 (0.35) ALDH1A1KDM4EPDGFRBPDGFRA
SCHEMBL10189728 0.85 SMPD3 (0.41) ALDH1A1KDM4EMAPK1PDGFRBMEN1
SCHEMBL10189703 0.84 SMPD3 (0.41) ALDH1A1KDM4EPDGFRBPDGFRAMEN1
SCHEMBL10189702 0.84 CHEK1 (0.38) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL10189743 0.83 LMNA (0.47) ALDH1A1MAPTLMNA
SCHEMBL10189705 0.82 S1PR1 (0.38) PDGFRBPDGFRASMN1; SMN2NPC1CYP17A1

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 ALDH1A1 1872/4885KDM4E 2492/4885MAPK1 750/4885

“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.