SCHEMBL2019117

SCHEMBL2019117

CCCCC[C@H]1CC[C@H](c2ccc(-c3ccc(C(=O)Nc4ccc(-c5ccc6c(c5)-c5c(c7c(c8cc(C(F)(F)F)ccc58)OC(c5ccccc5)(c5ccc(N8CCOCC8)cc5)C=C7)C6(C)C)c(C)c4)cc3)cc2)CC1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.38
DDR2 Q16832 2/20 0.38
RAF1 P04049 14/20 0.36
BRAF P15056 13/20 0.36
MAPK14 Q16539 2/20 0.34
BTK Q06187 1/20 0.34
RARB P10826 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
SCHEMBL12573758 1.00 FGFR1 (0.38) FGFR1DDR2RAF1BRAFMAPK14
SCHEMBL1332389 0.95 FGFR1 (0.35) FGFR1DDR2RAF1BRAFBTK
SCHEMBL9968003 0.95 FGFR1 (0.35) FGFR1DDR2RAF1BRAFBTK
SCHEMBL2015558 0.91 FGFR1 (0.34) FGFR1DDR2RAF1BRAFBTK
SCHEMBL12634342 0.91 FGFR1 (0.34) FGFR1DDR2RAF1BRAFBTK
SCHEMBL12573754 0.89 MAPT (0.35) RAF1
SCHEMBL1332426 0.89 MAPT (0.35) RAF1
SCHEMBL29910319 0.88 NPC1 (0.34) FGFR1DDR2RAF1BRAFMAPK14
SCHEMBL1331933 0.88 NPC1 (0.34) FGFR1DDR2RAF1BRAFMAPK14
SCHEMBL9973017 0.87 RAF1 (0.34) FGFR1DDR2RAF1BRAFMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2652552-B9 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL INC (US) 2016-02-17 EP disclosed
EP-2652552-B1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL INC (US) 2015-09-02 EP disclosed
US-8545984-B2 Photochromic compounds and compositions TRANSITIONS OPTICAL, INC. (US) 2013-10-01 US disclosed
US-20110129678-A1 Photochromic compounds and compositions TRANSITIONS OPTICAL, INC. (US) 2011-06-02 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 (1 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-20110129678-A1 Photochromic compounds and compositions CRY2, CRY1, PPOX FGFR1 3270/4885DDR2 1349/4885RAF1 3185/4885

“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.