SCHEMBL2695525

SCHEMBL2695525

CN(c1cc(Nc2ccc(F)cc2)ncc1C(N)=O)c1cccc2[nH]ccc12

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 4/20 0.41
▸ JAK2 O60674 8/20 0.40
▸ JAK1 P23458 8/20 0.40
▸ TYK2 P29597 7/20 0.40
▸ MAPK14 Q16539 1/20 0.40
▸ PARP1 P09874 1/20 0.40
▸ JAK3 P52333 4/20 0.38
▸ STAT3 P40763 1/20 0.38
▸ MAPK9 P45984 1/20 0.38
▸ MAPK10 P53779 1/20 0.38
▸ IRAK4 Q9NWZ3 2/20 0.37
▸ TTBK1 Q5TCY1 1/20 0.37
▸ TTBK2 Q6IQ55 1/20 0.37
▸ PDE4D Q08499 2/20 0.37
▸ SYK P43405 1/20 0.37
▸ LCK P06239 1/20 0.37
▸ ABL1 P00519 1/20 0.36
▸ BCR P11274 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
SCHEMBL2695887 0.93 CSF1R (0.39) CSF1RJAK2JAK1TYK2MAPK14
SCHEMBL2696012 0.90 CSF1R (0.42) CSF1RJAK2JAK1TYK2PARP1
SCHEMBL2695612 0.89 CSF1R (0.44) CSF1RMAPK14IRAK4TTBK1TTBK2
SCHEMBL2693114 0.88 CSF1R (0.42) CSF1RJAK2PARP1SYK
SCHEMBL2692967 0.88 SYK (0.42) CSF1RJAK2JAK1TYK2JAK3
SCHEMBL2695026 0.88 ABL1 (0.39) CSF1RJAK2JAK1TYK2JAK3
SCHEMBL2695179 0.88 ABL1 (0.53) TTBK1TTBK2SYKABL1BCR
SCHEMBL2696726 0.87 SYK (0.44) CSF1RJAK2JAK1TYK2JAK3
SCHEMBL2693148 0.86 SYK (0.45) CSF1RJAK2JAK1TYK2JAK3
SCHEMBL2693420 0.86 CSF1R (0.45) CSF1RJAK2JAK1TYK2JAK3

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 1106/4885JAK2 1/4885JAK1 2/4885
US-20120108566-A1 NICOTINAMIDES AS JAK KINASE MODULATORS JAK2, JAK1, NADK CSF1R 1106/4885JAK2 1/4885JAK1 2/4885

“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