SCHEMBL21943638

SCHEMBL21943638

Cc1ccc(Oc2cc(-c3cccnc3)nc3c2ccn3C)cc1NC(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 8/20 0.54
▸ CSF1R P07333 5/20 0.54
▸ PIKFYVE Q9Y2I7 2/20 0.53
▸ TEK Q02763 4/20 0.49
▸ ABL1 P00519 3/20 0.49
▸ BCR P11274 3/20 0.49
▸ ESYT2 A0FGR8 2/20 0.49
▸ NBAS A2RRP1 2/20 0.49
▸ CNOT1 A5YKK6 2/20 0.49
▸ TBKBP1 A7MCY6 2/20 0.49
▸ AGPS O00116 2/20 0.49
▸ MYO1F O00160 2/20 0.49
▸ SNAP23 O00161 2/20 0.49
▸ AP3B1 O00203 2/20 0.49
▸ PSMD12 O00232 2/20 0.49
▸ BMPR1B O00238 2/20 0.49
▸ PGRMC1 O00264 2/20 0.49
▸ CLIC1 O00299 2/20 0.49
▸ CDC7 O00311 2/20 0.49
▸ IPO5 O00410 2/20 0.49

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
SCHEMBL21943657 0.92 BRAF (0.53) BRAFCSF1RPIKFYVELCKMET
SCHEMBL21943735 0.89 BRAF (0.51) BRAFCSF1RPIKFYVETEKABL1
SCHEMBL21943517 0.87 TEK (0.57) BRAFCSF1RPIKFYVETEKABL1
SCHEMBL21943070 0.87 MEN1 (0.53) BRAFCSF1RPIKFYVETEKABL1
SCHEMBL21943016 0.86 PIKFYVE (0.70) BRAFCSF1RPIKFYVETEKABL1
SCHEMBL21943013 0.85 MAPK14 (0.54) BRAFCSF1RPIKFYVETEKABL1
SCHEMBL21943534 0.84 KDR (0.58) BRAFCSF1RPIKFYVETEKABL1
SCHEMBL22024869 0.83 PIKFYVE (0.73) BRAFCSF1RPIKFYVETEKABL1
SCHEMBL21943450 0.81 BRAF (0.51) BRAFTEKPDGFRBFGFR1MAPK1
SCHEMBL22024696 0.80 ABL1 (0.67) BRAFCSF1RPIKFYVETEKABL1

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-11319322-B2 Substituted aryl ether compound, preparation method thereof, pharmaceutical composition and use thereof XIAMEN UNIVERSITY (CN) 2022-05-03 — — US disclosed
US-20200123162-A1 SUBSTITUTED ARYL ETHER COMPOUND, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND USE THEREOF XIAMEN UNIVERSITY (CN) 2020-04-23 — — 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-20200123162-A1 SUBSTITUTED ARYL ETHER COMPOUND, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND USE THEREOF CYP4A11, CYP2D6, CYP3A43 BRAF 95/4885CSF1R 3749/4885PIKFYVE 2706/4885
US-11319322-B2 Substituted aryl ether compound, preparation method thereof, pharmaceutical composition and use thereof CYP4A11, CYP2D6, CYP3A43 BRAF 95/4885CSF1R 3749/4885PIKFYVE 2706/4885

“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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