SCHEMBL22606965

SCHEMBL22606965

O=C(NCc1nc2cc(F)ccc2[nH]1)C1CCN(Cc2c[nH]c3ccc(Cl)cc23)CC1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SOS1 Q07889 11/20 0.48
▸ ACHE P22303 5/20 0.43
▸ BCHE P06276 4/20 0.43
▸ MPO P05164 1/20 0.42
▸ ERCC1 P07992 1/20 0.42
▸ ERCC4 Q92889 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ ALOX12 P18054 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ PKM P14618 1/20 0.41

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
SCHEMBL22607141 0.94 SOS1 (0.51) SOS1ACHEBCHEGAAALOX12
SCHEMBL22607144 0.90 SOS1 (0.53) SOS1ACHEBCHE
SCHEMBL22606643 0.89 SOS1 (0.48) SOS1ACHEBCHEMPO
SCHEMBL22606795 0.89 SOS1 (0.48) SOS1ACHEBCHEGAAALOX12
SCHEMBL22607143 0.89 SOS1 (0.52) SOS1ACHEBCHEMPOERCC1
SCHEMBL22606967 0.89 SOS1 (0.46) SOS1ACHEBCHEMPOERCC1
SCHEMBL22606642 0.88 SOS1 (0.47) SOS1ACHEBCHEMPOERCC1
SCHEMBL22607055 0.87 MPO (0.46) SOS1ACHEMPO
SCHEMBL22606966 0.84 BCHE (0.52) SOS1ACHEBCHEERCC1ERCC4
SCHEMBL22607014 0.81 SOS1 (0.52) SOS1ACHEBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200339537-A1 NOVEL COMPOUND AS INHIBITOR AGAINST BINDING OF PF34 PROTEIN TO NEDD4-1 PROTEIN AND USE THEREOF ENHANCEDBIO, INC. (KR) 2020-10-29 — — 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 (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-20200339537-A1 NOVEL COMPOUND AS INHIBITOR AGAINST BINDING OF PF34 PROTEIN TO NEDD4-1 PROTEIN AND USE THEREOF NEDD4, PFDN1, PF4 SOS1 1806/4885ACHE 3500/4885BCHE 4287/4885

“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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