SCHEMBL22606643

SCHEMBL22606643

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

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SOS1 Q07889 4/20 0.48
▸ ATM Q13315 1/20 0.44
▸ CTNNB1 P35222 5/20 0.43
▸ TCF7L2 Q9NQB0 5/20 0.43
▸ KCNH2 Q12809 3/20 0.43
▸ MCHR1 Q99705 2/20 0.43
▸ BCHE P06276 4/20 0.41
▸ ACHE P22303 4/20 0.41
▸ MPO P05164 1/20 0.41
▸ CACNA1G O43497 2/20 0.39
▸ CACNA1B Q00975 1/20 0.39

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
SCHEMBL22606648 0.92 SOS1 (0.48) SOS1ATMCTNNB1TCF7L2KCNH2
SCHEMBL22606646 0.91 SOS1 (0.54) SOS1ATMKCNH2MCHR1BCHE
SCHEMBL22606641 0.90 SOS1 (0.47) SOS1ATMCTNNB1TCF7L2KCNH2
SCHEMBL22606965 0.89 SOS1 (0.48) SOS1BCHEACHEMPO
SCHEMBL22606653 0.88 LMNA (0.47) SOS1ATMCTNNB1TCF7L2BCHE
SCHEMBL22607143 0.87 SOS1 (0.52) SOS1BCHEACHEMPO
SCHEMBL22606967 0.87 SOS1 (0.46) SOS1BCHEACHEMPO
SCHEMBL22606642 0.87 SOS1 (0.47) SOS1BCHEACHEMPO
SCHEMBL22606654 0.84 BCHE (0.49) SOS1BCHEACHE
SCHEMBL22607141 0.83 SOS1 (0.51) SOS1BCHEACHE

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 1806/4885ATM 4064/4885CTNNB1 2542/4885

“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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