SCHEMBL2883891

SCHEMBL2883891

Cc1nc2cc(Cl)ccc2n1[C@H](C)c1ccc(C(=O)N2CC[C@H](N)C2)cc1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.45
PADI4 Q9UM07 5/20 0.42
HPGD P15428 2/20 0.41
GCGR P47871 2/20 0.40
CNR1 P21554 2/20 0.39
PKM P14618 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HRH3 Q9Y5N1 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL2879242 1.00 KDM1A (0.45) KDM1APADI4HPGDGCGRCNR1
SCHEMBL2881431 0.94 PADI4 (0.42) KDM1APADI4GCGRCNR1HRH3
SCHEMBL2881363 0.94 PADI4 (0.42) KDM1APADI4GCGRCNR1HRH3
SCHEMBL2879601 0.86 HRH3 (0.54) HPGDPKMSMN1; SMN2HRH3
SCHEMBL2885504 0.86 HRH3 (0.54) HPGDPKMSMN1; SMN2HRH3
SCHEMBL2887544 0.86 HRH3 (0.54) HPGDPKMSMN1; SMN2HRH3
SCHEMBL5483868 0.84 HPGD (0.48) HPGDCNR1PKMSMN1; SMN2HRH3
SCHEMBL2878841 0.80 HRH3 (0.57) HRH3MEN1KMT2A
SCHEMBL2886402 0.80 HRH3 (0.57) HRH3MEN1KMT2A
SCHEMBL14275540 0.73 HSD17B10 (0.61) HPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7820825-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2010-10-26 US claimed
EP-1994022-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS Wyeth a Corporation of the State of Delaware (US) 2008-11-26 EP claimed
WO-2007108936-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2007-09-27 WO claimed
US-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists WYETH (US) 2007-09-20 US claimed
US-7820825-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2010-10-26 US disclosed
EP-1994022-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS Wyeth a Corporation of the State of Delaware (US) 2008-11-26 EP disclosed
WO-2007108936-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2007-09-27 WO disclosed
US-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists WYETH (US) 2007-09-20 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-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists HNMT, HRH4, HRH3 KDM1A 540/4885PADI4 497/4885HPGD 508/4885

“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.