SCHEMBL2889846

SCHEMBL2889846

Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc(C(=O)N2CCC(N(C)C)C2)cc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.55
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
GAA P10253 1/20 0.54
MAPK1 P28482 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
ATR Q13535 1/20 0.54
LMNA P02545 3/20 0.54
HPGD P15428 2/20 0.54
NPSR1 Q6W5P4 1/20 0.53
TP53 P04637 1/20 0.52
MCHR1 Q99705 1/20 0.51
TSHR P16473 1/20 0.51

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
SCHEMBL2889406 0.82 MCHR1 (0.73) ATRMCHR1
SCHEMBL2886450 0.75 MCHR1 (0.58) ALDH1A1SMN1; SMN2ATRMCHR1
SCHEMBL12585052 0.75 MAPK1 (0.79) GHSRKDM4EALDH1A1MAPK1SMN1; SMN2
SCHEMBL2885651 0.74 ATR (0.57) KDM4ESMN1; SMN2ATRMCHR1
SCHEMBL13501815 0.74 ALDH1A1 (0.84) GHSRKDM4EALDH1A1MAPK1SMN1; SMN2
SCHEMBL10293598 0.73 L3MBTL3 (0.69) KDM4ESMN1; SMN2ATR
SCHEMBL10293555 0.73 L3MBTL3 (0.69) KDM4ESMN1; SMN2ATR
SCHEMBL2890112 0.73 ATR (0.56) ALDH1A1MAPK1SMN1; SMN2ATRMCHR1
SCHEMBL13501816 0.73 GAA (0.74) GHSRKDM4EALDH1A1GAAMAPK1
SCHEMBL2885719 0.72 ATR (0.55) ATRMCHR1

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-20070270440-A1 N-benzoyl- and N-benzylpyrrolidin-3-ylamines as histamine-3 antagonists WYETH (US) 2007-11-22 US claimed
US-7842715-B2 N-benzoyl- and N-benzylpyrrolidin-3-ylamines as histamine-3 antagonists WYETH LLC (US) 2010-11-30 US disclosed
US-20070270440-A1 N-benzoyl- and N-benzylpyrrolidin-3-ylamines as histamine-3 antagonists WYETH (US) 2007-11-22 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-20070270440-A1 N-benzoyl- and N-benzylpyrrolidin-3-ylamines as histamine-3 antagonists HRH4, HRH3, HRH2 GHSR 239/4885KDM4E 1644/4885ALDH1A1 2242/4885

“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.