SCHEMBL23091701

SCHEMBL23091701

O=C(Nc1ccc(OC(F)(F)Cl)cc1)c1ccc(=O)n(-c2ccccc2)c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 4/20 0.48
▸ ABL1 P00519 7/20 0.47
▸ POLB P06746 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.46
▸ NAMPT P43490 1/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ FLT1 P17948 1/20 0.43
▸ KDR P35968 1/20 0.43
▸ F10 P00742 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ TNF P01375 1/20 0.42
▸ NOD2 Q9HC29 1/20 0.42
▸ NOD1 Q9Y239 1/20 0.42

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
SCHEMBL23091708 0.90 TRPV1 (0.47) TRPV1ABL1ALDH1A1NPC1RAB9A
SCHEMBL23091719 0.89 RAB9A (0.50) TRPV1ABL1POLBALDH1A1NPC1
SCHEMBL23091652 0.89 ABL1 (0.48) TRPV1ABL1ALDH1A1
SCHEMBL29687226 0.89 ABL1 (0.51) ABL1POLBNPC1RAB9AFLT1
SCHEMBL23091643 0.89 ABL1 (0.51) ABL1POLBNPC1RAB9AFLT1
SCHEMBL29687788 0.89 ABL1 (0.48) TRPV1ABL1ALDH1A1
SCHEMBL29687554 0.88 ABL1 (0.43) TRPV1ABL1POLBALDH1A1NAMPT
SCHEMBL29687405 0.88 RAB9A (0.53) ABL1ALDH1A1NPC1RAB9AF10
SCHEMBL23091691 0.88 RAB9A (0.53) ABL1ALDH1A1NPC1RAB9AF10
SCHEMBL23091681 0.87 ABL1 (0.47) TRPV1ABL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230002346-A1 NEW COMPOUNDS AND METHODS BenevolentAl Bio Limited (GB) 2023-01-05 — — US claimed
EP-4028387-A1 NEW COMPOUNDS AND METHODS BenevolentAI Bio Limited (GB) 2022-07-20 — — EP claimed
WO-2021048567-A1 NEW COMPOUNDS AND METHODS BENEVOLENTAI BIO LIMITED (GB) 2021-03-18 — — WO claimed
US-20230002346-A1 NEW COMPOUNDS AND METHODS BenevolentAl Bio Limited (GB) 2023-01-05 — — US disclosed
US-20230002346-A1 NEW COMPOUNDS AND METHODS BenevolentAl Bio Limited (GB) 2023-01-05 — — US disclosed
EP-4028387-A1 NEW COMPOUNDS AND METHODS BenevolentAI Bio Limited (GB) 2022-07-20 — — EP disclosed
WO-2021048567-A1 NEW COMPOUNDS AND METHODS BENEVOLENTAI BIO LIMITED (GB) 2021-03-18 — — WO 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-20230002346-A1 NEW COMPOUNDS AND METHODS ABL2, ABL1, ALK TRPV1 1085/4885ABL1 2/4885POLB 3091/4885

“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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