SCHEMBL2692782

SCHEMBL2692782

COc1ccc(Nc2cc(N(C)c3cccc(F)n3)c(C(N)=O)cn2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 4/20 0.44
▸ SYK P43405 1/20 0.41
▸ MAPK10 P53779 2/20 0.41
▸ MAPK9 P45984 2/20 0.41
▸ PDE4B Q07343 3/20 0.41
▸ MAPK8 P45983 2/20 0.40
▸ PARP1 P09874 1/20 0.40
▸ EGFR P00533 1/20 0.39
▸ ERBB3 P21860 1/20 0.39
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ IRAK4 Q9NWZ3 1/20 0.39
▸ JAK2 O60674 1/20 0.39
▸ JAK1 P23458 1/20 0.39
▸ TYK2 P29597 1/20 0.39
▸ JAK3 P52333 1/20 0.39
▸ P2RX3 P56373 1/20 0.39
▸ POLB P06746 1/20 0.39

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
SCHEMBL2696685 0.88 SYK (0.48) CSF1RSYKMAPK10MAPK9PARP1
SCHEMBL2694009 0.87 SIRT2 (0.44) CSF1RSYKMAPK10MAPK9MAPK8
SCHEMBL2695292 0.86 MAPK9 (0.53) SYKMAPK10MAPK9PDE4BMEN1
SCHEMBL2696558 0.86 SYK (0.46) SYKMAPK10MAPK9PARP1IRAK4
SCHEMBL2695391 0.83 SYK (0.49) SYKMAPK10MAPK9PARP1IRAK4
SCHEMBL2696618 0.83 CSF1R (0.49) CSF1RSYKMAPK10MAPK9PDE4B
SCHEMBL2695760 0.82 SYK (0.52) CSF1RSYKMAPK10MAPK9PARP1
SCHEMBL2695699 0.80 CSF1R (0.48) CSF1RSYKMAPK10MAPK9PARP1
SCHEMBL2693091 0.80 JAK3 (0.41) SYKEGFRIRAK4JAK2JAK1
SCHEMBL2694449 0.80 CSF1R (0.45) CSF1RSYKMAPK10MAPK9MAPK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150353495-A1 NICOTINAMIDES AS JAK KINASE MODULATORS ALEXION PHARMACEUTICALS, INC. 2015-12-10 — — US claimed
EP-2635557-A2 NICOTINAMIDES AS JAK KINASE MODULATORS Portola Pharmaceuticals, Inc. (US) 2013-09-11 — — EP claimed
WO-2012061428-A2 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 — — WO claimed
US-20120108566-A1 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-03 — — US claimed
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-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
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 CSF1R 1106/4885SYK 17/4885MAPK10 260/4885
US-20120108566-A1 NICOTINAMIDES AS JAK KINASE MODULATORS JAK2, JAK1, NADK CSF1R 1106/4885SYK 17/4885MAPK10 260/4885

“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.

Send feedback