SCHEMBL938113

SCHEMBL938113

CC(C)(C)c1cc(Nc2ccc(C([NH])=O)cc2Sc2ccncc2)no1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 7/20 0.45
SMN1; SMN2 Q16637 1/20 0.41
RAF1 P04049 5/20 0.41
RIPK2 O43353 1/20 0.41
MAPT P10636 3/20 0.38
HTT P42858 3/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
ATM Q13315 1/20 0.38
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPK13 O15264 1/20 0.37
MAPK14 Q16539 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
EGFR P00533 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
SCHEMBL937136 0.82 RAF1 (0.41) FLT3RAF1MAPK13MAPK14
SCHEMBL937528 0.76 MAPT (0.40) FLT3SMN1; SMN2RAF1MAPTHTT
SCHEMBL939287 0.76 MAPK14 (0.35) FLT3SMN1; SMN2MAPK14
SCHEMBL939125 0.70 MAPK13 (0.44) FLT3SMN1; SMN2RAF1RIPK2MAPT
SCHEMBL937007 0.69 RAF1 (0.57) FLT3RAF1MAPK13MAPK14
SCHEMBL668678 0.69 FLT3 (0.73) FLT3RAF1RIPK2RAB9ANPC1
SCHEMBL667804 0.67 FLT3 (0.59) FLT3RAF1RIPK2RAB9ANPC1
SCHEMBL668089 0.66 MEN1 (0.63) FLT3RAF1RIPK2RAB9ANPC1
SCHEMBL667543 0.64 FLT3 (0.61) FLT3RAF1RIPK2RAB9ANPC1
SCHEMBL13234454 0.63 FLT3 (0.83) FLT3RAF1RIPK2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7838541-B2 Aryl ureas with angiogenesis inhibiting activity BAYER HEALTHCARE, LLC (US) 2010-11-23 US claimed
US-10653684-B2 Aryl ureas with angiogenisis inhibiting activity BAYER HEALTHCARE LLC (US) 2020-05-19 US disclosed
US-20180296541-A9 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY BAYER HEALTHCARE LLC (US) 2018-10-18 US disclosed
US-20160015697-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY BAYER HEALTHCARE LLC (US) 2016-01-21 US disclosed
US-8618141-B2 Aryl ureas with angiogenesis inhibiting activity BAYER HEALTHCARE LLC (US) 2013-12-31 US disclosed
US-20120289552-A1 ARYL UREAS WITH ANGIOGENESIS INHIBITING ACTIVITY BAYER HEALTHCARE LLC (US) 2012-11-15 US disclosed
US-8242147-B2 Aryl ureas with angiogenisis inhibiting activity BAYER HEALTHCARE LLC (US) 2012-08-14 US disclosed
EP-2324825-A1 Aryl ureas with angiogenesis inhibiting activity Bayer Healthcare LLC (US) 2011-05-25 EP disclosed
US-20110015195-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY DUMAS JACQUES 2011-01-20 US disclosed
US-7838541-B2 Aryl ureas with angiogenesis inhibiting activity BAYER HEALTHCARE, LLC (US) 2010-11-23 US disclosed
US-20080227828-A1 Aryl Ureas With Angiogenisis Inhibiting Activity BAYER HEALTHCARE LLC 2008-09-18 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 (6 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-20180296541-A9 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY FLT1, FLT4, KDR FLT3 200/4885SMN1; SMN2 4480/4885RAF1 867/4885
US-10653684-B2 Aryl ureas with angiogenisis inhibiting activity FLT1, FLT4, KDR FLT3 200/4885SMN1; SMN2 4480/4885RAF1 867/4885
US-20110015195-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY FLT1, FLT4, KDR FLT3 200/4885SMN1; SMN2 4480/4885RAF1 867/4885
US-20080227828-A1 Aryl Ureas With Angiogenisis Inhibiting Activity FLT1, FLT4, KDR FLT3 200/4885SMN1; SMN2 4480/4885RAF1 867/4885
US-20120289552-A1 ARYL UREAS WITH ANGIOGENESIS INHIBITING ACTIVITY FLT4, FLT1, KDR FLT3 140/4885SMN1; SMN2 4628/4885RAF1 817/4885
US-20160015697-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY FLT1, FLT4, KDR FLT3 200/4885SMN1; SMN2 4480/4885RAF1 867/4885

“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.