SCHEMBL15728544

SCHEMBL15728544

COc1cc(Nc2ncc(OCc3c(F)cccc3F)cn2)ccc1N1CCC(N2CCNCC2)CC1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FGFR3 P22607 18/20 0.69
▸ KCNH2 Q12809 6/20 0.64
▸ FGFR1 P11362 1/20 0.56
▸ FGFR2 P21802 1/20 0.56
▸ FGFR4 P22455 1/20 0.56
▸ KDR P35968 1/20 0.56
▸ CDK1 P06493 1/20 0.47
▸ CDK4 P11802 1/20 0.47
▸ CCNB1 P14635 1/20 0.47
▸ CCND1 P24385 1/20 0.47
▸ CCNE1 P24864 1/20 0.47
▸ CDK2 P24941 1/20 0.47

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
SCHEMBL15728573 0.93 FGFR3 (0.71) FGFR3KCNH2FGFR1FGFR2FGFR4
SCHEMBL15728667 0.92 FGFR3 (0.74) FGFR3KCNH2FGFR1FGFR2FGFR4
SCHEMBL15728436 0.91 FGFR3 (0.83) FGFR3KCNH2FGFR1FGFR2FGFR4
SCHEMBL15244583 0.91 FGFR3 (0.83) FGFR3KCNH2FGFR1FGFR2FGFR4
SCHEMBL18132715 0.89 FGFR3 (0.77) FGFR3KCNH2FGFR1FGFR2FGFR4
SCHEMBL15728484 0.89 FGFR3 (0.72) FGFR3KCNH2FGFR1FGFR2FGFR4
SCHEMBL15728569 0.89 FGFR3 (0.69) FGFR3KCNH2FGFR1FGFR2FGFR4
SCHEMBL15728440 0.88 FGFR3 (0.68) FGFR3KCNH2FGFR1FGFR2FGFR4
SCHEMBL15728621 0.88 FGFR3 (0.75) FGFR3KCNH2FGFR1FGFR2FGFR4
SCHEMBL15728579 0.87 KCNH2 (0.84) FGFR3KCNH2FGFR1FGFR2FGFR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9464077-B2 Nitrogen-containing aromatic heterocyclic compound ASTELLAS PHARMA INC. (JP) 2016-10-11 — — US disclosed
US-20140142084-A1 NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPOUND KOTOBUKI PHARMACEUTICAL CO., LTD. (JP) 2014-05-22 — — 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-20140142084-A1 NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPOUND FGFR3, FGFR1, FGFR2 FGFR3 1/4885KCNH2 3097/4885FGFR1 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.

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