SCHEMBL10044792

SCHEMBL10044792

CC(C)[C@@H](Nc1nc(-c2ccc(O)cc2)ncc1F)C(=O)NCC(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 9/20 0.38
TRPV3 Q8NET8 1/20 0.38
AURKA O14965 4/20 0.37
KDR P35968 5/20 0.36
ULK1 O75385 2/20 0.35
GABRA5 P31644 1/20 0.34
JAK2 O60674 1/20 0.34
JAK3 P52333 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
SCHEMBL10044759 0.89 FGFR3 (0.39) FGFR3TRPV3KDRULK1
SCHEMBL10044660 0.86 PTGES (0.39) FGFR3KDRULK1GABRA5JAK2
SCHEMBL10044807 0.85 FGFR3 (0.39) FGFR3TRPV3KDRULK1
SCHEMBL10044673 0.85 FGFR3 (0.37) FGFR3TRPV3KDRULK1JAK2
SCHEMBL10044654 0.83 AKR1C3 (0.41) FGFR3KDRJAK2JAK3
SCHEMBL10044810 0.83 PRMT7 (0.46) FGFR3KDR
SCHEMBL10044686 0.83 PRMT7 (0.46) FGFR3
SCHEMBL10072308 0.81 ATM (0.36) FGFR3TRPV3KDRJAK2JAK3
SCHEMBL10044687 0.81 PI4KA (0.40) FGFR3
SCHEMBL10044717 0.81 FGFR3 (0.37) FGFR3KDRULK1JAK2JAK3

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 574/4885TRPV3 3432/4885AURKA 300/4885
US-20100160287-A1 COMPOUNDS USEFUL AS INHIBITORS OF JANUS KINASES JAK2, JAK1, JAK3 FGFR3 574/4885TRPV3 3432/4885AURKA 300/4885
US-20140221336-A1 COMPOUNDS USEFUL AS INHIBITORS OF JANUS KINASES JAK2, JAK1, JAK3 FGFR3 574/4885TRPV3 3432/4885AURKA 300/4885

“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.