SCHEMBL4355716

SCHEMBL4355716

Cc1cc(C(=O)NC(c2ccccc2)C2(N(C)C)CCCC2)c2ccccc2n1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.53
RAB9A P51151 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
TACR3 P29371 2/20 0.48
GAA P10253 1/20 0.48
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
NPC1 O15118 1/20 0.46

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
SCHEMBL8263977 0.88 GAA (0.50) RAB9ACYP1A2CYP3A4CYP2C19MEN1
SCHEMBL4357027 0.86 TACR3 (0.46) CYP1A2CYP3A4CYP2C9CYP2C19TDP1
SCHEMBL8264900 0.85 SMN1; SMN2 (0.53) SMN1; SMN2RAB9ACYP1A2CYP3A4CYP2C9
SCHEMBL4361680 0.85 TACR3 (0.45) CYP1A2CYP3A4CYP2C9CYP2C19TDP1
SCHEMBL4365697 0.85 TACR3 (0.60) RAB9ACYP1A2CYP2C9CYP2C19MEN1
SCHEMBL4540492 0.84 KDM4E (0.48) SMN1; SMN2L3MBTL1MEN1KMT2ALMNA
SCHEMBL4352703 0.84 PREP (0.49) TACR3
SCHEMBL4365387 0.83 TACR3 (0.62) RAB9ATDP1L3MBTL1MEN1KMT2A
SCHEMBL4367407 0.82 NSD2 (0.48) TACR3KDM4EALDH1A1
SCHEMBL3237287 0.79 SLC6A9 (0.45) RAB9ACYP1A2CYP2C19LMNANPC1

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-20090286828-A1 2-AMINO-1-PHENYLETHYLCARBOXAMIDE DERIVATIVES GLAXO GROUP LIMITED (GB) 2009-11-19 US disclosed
US-20090286828-A1 2-AMINO-1-PHENYLETHYLCARBOXAMIDE DERIVATIVES GLAXO GROUP LIMITED (GB) 2009-11-19 US disclosed
US-20090286828-A1 2-AMINO-1-PHENYLETHYLCARBOXAMIDE DERIVATIVES GLAXO GROUP LIMITED (GB) 2009-11-19 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-20090286828-A1 2-AMINO-1-PHENYLETHYLCARBOXAMIDE DERIVATIVES PNMT, SLC18A2, COMT SMN1; SMN2 1247/4885RAB9A 2138/4885CYP1A2 174/4885

“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.