SCHEMBL22024781

SCHEMBL22024781

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1cc(-c2cccnc2)nc2sccc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIKFYVE Q9Y2I7 1/20 0.65
▸ CSF1R P07333 3/20 0.62
▸ ABL1 P00519 8/20 0.62
▸ BCR P11274 8/20 0.62
▸ MAPK14 Q16539 5/20 0.62
▸ DDR1 Q08345 4/20 0.62
▸ DDR2 Q16832 4/20 0.62
▸ LCK P06239 4/20 0.62
▸ BRAF P15056 4/20 0.62
▸ SRC P12931 3/20 0.62
▸ EPHB2 P29323 3/20 0.62
▸ KDR P35968 3/20 0.62
▸ ESYT2 A0FGR8 2/20 0.62
▸ NBAS A2RRP1 2/20 0.62
▸ CNOT1 A5YKK6 2/20 0.62
▸ TBKBP1 A7MCY6 2/20 0.62
▸ AGPS O00116 2/20 0.62
▸ MYO1F O00160 2/20 0.62
▸ SNAP23 O00161 2/20 0.62
▸ AP3B1 O00203 2/20 0.62

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
SCHEMBL22024822 0.94 PIKFYVE (0.74) PIKFYVECSF1RABL1BCRMAPK14
SCHEMBL22025503 0.92 POLB (0.63) PIKFYVECSF1RABL1BCRMAPK14
SCHEMBL22024791 0.90 MEN1 (0.57) PIKFYVECSF1RABL1BCRMAPK14
SCHEMBL22024786 0.88 PIKFYVE (0.58) PIKFYVECSF1RABL1BCRBRAF
SCHEMBL22024821 0.86 PIKFYVE (0.62) PIKFYVECSF1RBRAFKDRPDGFRB
SCHEMBL22066433 0.85 PIKFYVE (0.52) PIKFYVECSF1RABL1BCRMAPK14
SCHEMBL22024551 0.85 PIKFYVE (0.88) PIKFYVECSF1RABL1BCRMAPK14
SCHEMBL5029480 0.84 ABL1 (0.73) CSF1RABL1BCRMAPK14DDR1
SCHEMBL22024696 0.84 ABL1 (0.67) PIKFYVECSF1RABL1BCRMAPK14
SCHEMBL24532082 0.82 DDR1 (0.71) PIKFYVECSF1RABL1BCRMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11352354-B2 Substituted penta-fused hexa-heterocyclic compounds, preparation method therefor, drug combination and use thereof XIAMEN UNIVERSITY (CN) 2022-06-07 — — US disclosed
EP-3663293-A1 SUBSTITUTED PENTA- AND HEXA-HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, DRUG COMBINATION AND USE THEREOF Xiamen University (CN) 2020-06-10 — — EP disclosed
US-20200165246-A1 SUBSTITUTED PENTA-FUSED HEXA-HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, DRUG COMBINATION AND USE THEREOF XIAMEN UNIVERSITY (CN) 2020-05-28 — — 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-11352354-B2 Substituted penta-fused hexa-heterocyclic compounds, preparation method therefor, drug combination and use thereof PIKFYVE, PIK3CA, PIK3C2A PIKFYVE 1/4885CSF1R 3197/4885ABL1 1429/4885
US-20200165246-A1 SUBSTITUTED PENTA-FUSED HEXA-HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, DRUG COMBINATION AND USE THEREOF PIKFYVE, PIK3CA, PIK3C2A PIKFYVE 1/4885CSF1R 3197/4885ABL1 1429/4885

“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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