SCHEMBL22025503

SCHEMBL22025503

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1cc(-c2ccncc2)nc2sccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.63
▸ APEX1 P27695 2/20 0.56
▸ MAPT P10636 2/20 0.56
▸ MAPK14 Q16539 5/20 0.55
▸ LCK P06239 4/20 0.55
▸ BRAF P15056 4/20 0.55
▸ KDR P35968 3/20 0.55
▸ TEK Q02763 1/20 0.55
▸ CSF1R P07333 2/20 0.55
▸ SRC P12931 3/20 0.54
▸ KIT P10721 2/20 0.54
▸ PIKFYVE Q9Y2I7 1/20 0.54
▸ DDR1 Q08345 5/20 0.54
▸ DDR2 Q16832 5/20 0.54
▸ EPHB2 P29323 3/20 0.54
▸ HTT P42858 1/20 0.52
▸ MAPK1 P28482 3/20 0.52
▸ MAPK10 P53779 3/20 0.52
▸ ESYT2 A0FGR8 2/20 0.52
▸ NBAS A2RRP1 2/20 0.52

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
SCHEMBL22024821 0.94 PIKFYVE (0.62) POLBMAPTBRAFKDRTEK
SCHEMBL22024781 0.92 PIKFYVE (0.65) POLBAPEX1MAPTMAPK14LCK
SCHEMBL22025088 0.89 MAPT (0.56) POLBMAPTBRAFMAPK1MAPK10
SCHEMBL22024619 0.88 MAPT (0.56) POLBMAPTBRAFPIKFYVEMAPK1
SCHEMBL22024822 0.86 PIKFYVE (0.74) APEX1MAPK14LCKBRAFKDR
SCHEMBL22024705 0.85 PIKFYVE (0.75) POLBAPEX1MAPTMAPK14LCK
SCHEMBL5023651 0.84 POLB (0.68) POLBAPEX1MAPTMAPK14LCK
SCHEMBL24532071 0.84 POLB (0.68) POLBAPEX1MAPTMAPK14LCK
SCHEMBL22065428 0.83 POLB (0.58) POLBAPEX1MAPTMAPK14LCK
SCHEMBL22066435 0.82 POLB (0.49) POLBAPEX1MAPTMAPK14LCK

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 POLB 1927/4885APEX1 4845/4885MAPT 2459/4885
US-20200165246-A1 SUBSTITUTED PENTA-FUSED HEXA-HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, DRUG COMBINATION AND USE THEREOF PIKFYVE, PIK3CA, PIK3C2A POLB 1927/4885APEX1 4845/4885MAPT 2459/4885

“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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