SCHEMBL2694980

SCHEMBL2694980

COc1ccc(Nc2cc(Nc3ccc(N4CCOCC4)cc3)c(C(N)=O)cn2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 5/20 0.59
MAPK9 P45984 2/20 0.59
CSF1R P07333 4/20 0.56
STAT6 P42226 2/20 0.55
MAPT P10636 3/20 0.51
KDR P35968 2/20 0.51
DAPK1 P53355 2/20 0.51
BRAF P15056 1/20 0.51
MAPK1 P28482 3/20 0.49
FGFR4 P22455 2/20 0.49
ABL1 P00519 1/20 0.49
NTRK1 P04629 1/20 0.49
YES1 P07947 1/20 0.49
PIM1 P11309 1/20 0.49
HIPK1 Q86Z02 1/20 0.49
SYK P43405 1/20 0.49
POLB P06746 1/20 0.48
TSHR P16473 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL2697795 0.92 MAPK10 (0.67) MAPK10MAPK9STAT6SYK
SCHEMBL2478948 0.91 STAT6 (0.61) MAPK10MAPK9CSF1RSTAT6MAPT
SCHEMBL2693804 0.86 CSF1R (0.56) MAPK10MAPK9CSF1RSYKKMT2A
SCHEMBL2477947 0.85 STAT6 (0.74) MAPK10MAPK9CSF1RSTAT6MAPT
SCHEMBL29127191 0.84 CCND3 (0.55) CSF1RMAPTSYKKMT2ASMN1; SMN2
SCHEMBL2694558 0.82 AKR1C3 (0.55) CSF1RSYKKMT2A
SCHEMBL2472290 0.82 STAT6 (0.72) MAPK10MAPK9STAT6SMN1; SMN2HSD17B10
SCHEMBL2482974 0.81 STAT6 (0.61) MAPK10MAPK9STAT6KMT2A
SCHEMBL2485932 0.80 MAPK9 (0.56) MAPK10MAPK9STAT6SYK
SCHEMBL5027903 0.80 SYK (0.65) MAPK10MAPK9SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2975027-A1 NICOTINAMIDES AS JAK KINASE MODULATORS Portola Pharmaceuticals, Inc. (US) 2016-01-20 EP disclosed
EP-2975027-A1 NICOTINAMIDES AS JAK KINASE MODULATORS Portola Pharmaceuticals, Inc. (US) 2016-01-20 EP disclosed
US-20150353495-A1 NICOTINAMIDES AS JAK KINASE MODULATORS ALEXION PHARMACEUTICALS, INC. 2015-12-10 US disclosed
US-20150353495-A1 NICOTINAMIDES AS JAK KINASE MODULATORS ALEXION PHARMACEUTICALS, INC. 2015-12-10 US disclosed
US-20150353495-A1 NICOTINAMIDES AS JAK KINASE MODULATORS ALEXION PHARMACEUTICALS, INC. 2015-12-10 US disclosed
US-9102625-B2 Nicotinamides as JAK kinase modulators PORTOLA PHARMACEUTICALS, INC. (US) 2015-08-11 US disclosed
US-9102625-B2 Nicotinamides as JAK kinase modulators PORTOLA PHARMACEUTICALS, INC. (US) 2015-08-11 US disclosed
US-9102625-B2 Nicotinamides as JAK kinase modulators PORTOLA PHARMACEUTICALS, INC. (US) 2015-08-11 US disclosed
EP-2635557-A2 NICOTINAMIDES AS JAK KINASE MODULATORS Portola Pharmaceuticals, Inc. (US) 2013-09-11 EP disclosed
WO-2012061428-A2 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 WO disclosed
WO-2012061428-A2 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 WO disclosed
US-20120108566-A1 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-03 US disclosed
US-20120108566-A1 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-03 US disclosed
US-20120108566-A1 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-03 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-20150353495-A1 NICOTINAMIDES AS JAK KINASE MODULATORS JAK2, JAK1, NADK MAPK10 260/4885MAPK9 124/4885CSF1R 1106/4885
US-20120108566-A1 NICOTINAMIDES AS JAK KINASE MODULATORS JAK2, JAK1, NADK MAPK10 260/4885MAPK9 124/4885CSF1R 1106/4885

“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.