SCHEMBL10044807

SCHEMBL10044807

CC(C)[C@@H](Nc1nc(-c2ccc3nccnc3c2)ncc1F)C(=O)NCC(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 12/20 0.39
KDR P35968 7/20 0.38
CDK6 Q00534 2/20 0.36
PIM1 P11309 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.35
ULK1 O75385 2/20 0.35
TRPV3 Q8NET8 1/20 0.34

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
SCHEMBL10044654 0.90 AKR1C3 (0.41) FGFR3KDRIRAK4
SCHEMBL10044792 0.85 FGFR3 (0.38) FGFR3KDRULK1TRPV3
SCHEMBL10044687 0.84 PI4KA (0.40) FGFR3
SCHEMBL10044786 0.84 ROCK2 (0.38) FGFR3KDRIRAK4
SCHEMBL10044759 0.83 FGFR3 (0.39) FGFR3KDRULK1TRPV3
SCHEMBL10044810 0.83 PRMT7 (0.46) FGFR3KDRCDK6
SCHEMBL10044686 0.83 PRMT7 (0.46) FGFR3CDK6
SCHEMBL10044660 0.82 PTGES (0.39) FGFR3KDRULK1
SCHEMBL10044673 0.81 FGFR3 (0.37) FGFR3KDRULK1TRPV3
SCHEMBL10044780 0.80 FGFR3 (0.42) FGFR3KDRULK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140221336-A1 COMPOUNDS USEFUL AS INHIBITORS OF JANUS KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-08-07 US disclosed
US-20140221336-A1 COMPOUNDS USEFUL AS INHIBITORS OF JANUS KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-08-07 US disclosed
US-20120157429-A1 COMPOUNDS USEFUL AS INHIBITORS OF JANUS KINASES VERTEX PHARMACEUTICALS INCORPORATED 2012-06-21 US disclosed
US-20120157429-A1 COMPOUNDS USEFUL AS INHIBITORS OF JANUS KINASES VERTEX PHARMACEUTICALS INCORPORATED 2012-06-21 US disclosed
US-20100160287-A1 COMPOUNDS USEFUL AS INHIBITORS OF JANUS KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-06-24 US disclosed
US-20100160287-A1 COMPOUNDS USEFUL AS INHIBITORS OF JANUS KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-06-24 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 (3 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-20120157429-A1 COMPOUNDS USEFUL AS INHIBITORS OF JANUS KINASES JAK2, JAK1, JAK3 FGFR3 574/4885KDR 997/4885CDK6 63/4885
US-20100160287-A1 COMPOUNDS USEFUL AS INHIBITORS OF JANUS KINASES JAK2, JAK1, JAK3 FGFR3 574/4885KDR 997/4885CDK6 63/4885
US-20140221336-A1 COMPOUNDS USEFUL AS INHIBITORS OF JANUS KINASES JAK2, JAK1, JAK3 FGFR3 574/4885KDR 997/4885CDK6 63/4885

“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.