SCHEMBL14983419

SCHEMBL14983419

FC(F)(F)c1ncnc2c1ncn2-c1cccs1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 1/20 0.36
▸ PI4KA P42356 9/20 0.35
▸ PI4K2B Q8TCG2 9/20 0.35
▸ PI4K2A Q9BTU6 9/20 0.35
▸ PI4KB Q9UBF8 9/20 0.35
▸ EGFR P00533 1/20 0.35
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ NSD2 O96028 1/20 0.30
▸ NSD3 Q9BZ95 1/20 0.30

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
SCHEMBL14983422 0.81 FGFR1 (0.41) FGFR1PI4KAPI4K2BPI4K2API4KB
SCHEMBL14983421 0.78 PI4KA (0.39) FGFR1PI4KAPI4K2BPI4K2API4KB
SCHEMBL2020952 0.78 PI4KA (0.59) PI4KAPI4K2BPI4K2API4KBEGFR
Hydrochloric Acid SCHEMBL1895413 0.77 PI4KA (0.57) PI4KAPI4K2BPI4K2API4KBEGFR
SCHEMBL14983413 0.75 PI4KA (0.38) FGFR1PI4KAPI4K2BPI4K2API4KB
SCHEMBL14983415 0.72 PI4KA (0.35) PI4KAPI4K2BPI4K2API4KBEGFR
SCHEMBL14983409 0.69 PI4KA (0.38) PI4KAPI4K2BPI4K2API4KBEGFR
SCHEMBL1811574 0.68 CYP1A2 (0.45) FGFR1
SCHEMBL1899765 0.62 XDH (0.64) —
SCHEMBL1307843 0.60 FGFR1 (0.60) FGFR1

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-20160083388-A1 NOVEL MODULATORS OF NRF2 AND USES THEREOF TRT PHARMA INC. (CA) 2016-03-24 — — US disclosed
US-20160083388-A1 NOVEL MODULATORS OF NRF2 AND USES THEREOF TRT PHARMA INC. (CA) 2016-03-24 — — US disclosed
US-9139592-B2 Modulators of Nrf2 and uses thereof TRT PHARMA INC. (CA) 2015-09-22 — — US disclosed
US-9139592-B2 Modulators of Nrf2 and uses thereof TRT PHARMA INC. (CA) 2015-09-22 — — US disclosed
US-20130137694-A1 NOVEL MODULATORS OF NRF2 AND USES THEREOF TRT PHARMA INC. (CA) 2013-05-30 — — US disclosed
US-20130137694-A1 NOVEL MODULATORS OF NRF2 AND USES THEREOF TRT PHARMA INC. (CA) 2013-05-30 — — 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-20130137694-A1 NOVEL MODULATORS OF NRF2 AND USES THEREOF KEAP1, TXNRD1, NFE2L2 FGFR1 3580/4885PI4KA 1826/4885PI4K2B 1290/4885
US-20160083388-A1 NOVEL MODULATORS OF NRF2 AND USES THEREOF KEAP1, TXNRD1, NFE2L2 FGFR1 3580/4885PI4KA 1826/4885PI4K2B 1290/4885

“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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