SCHEMBL6623958

SCHEMBL6623958

NC(=O)N1CCC(N)(C(=O)OCCc2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.44
CHRM1 P11229 2/20 0.44
CHRM3 P20309 2/20 0.44
LTA4H P09960 1/20 0.43
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
ALDH1A1 P00352 3/20 0.42
LMNA P02545 1/20 0.42
OPRD1 P41143 1/20 0.42
OPRK1 P41145 1/20 0.42
AKR1B10 O60218 3/20 0.42
AKR1B1 P15121 3/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TP53 P04637 1/20 0.42
GLA P06280 1/20 0.42
CYP3A4 P08684 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL185174 0.75 ESR1 (0.43) CHRM5CHRM1CHRM3ESR1ESR2
SCHEMBL4034005 0.75 SMN1; SMN2 (0.53) CHRM5CHRM1CHRM3ALDH1A1NPC1
SCHEMBL2808356 0.75 ESR1 (0.43) CHRM5CHRM1CHRM3ESR1ESR2
SCHEMBL3556103 0.72 CYP2C19 (0.47) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL24568094 0.71 OPRM1 (0.50) ALDH1A1OPRD1OPRK1
SCHEMBL14902486 0.71 NPC1 (0.51) ALDH1A1LMNAOPRD1OPRK1NPC1
SCHEMBL8391955 0.71 HCAR2 (0.49) CHRM5CHRM1CHRM3ESR1ESR2
SCHEMBL27509981 0.71 CHRM5 (0.64) CHRM5CHRM1CHRM3ALDH1A1OPRD1
SCHEMBL3563828 0.71 MEN1 (0.56) CHRM5CHRM1CHRM3OPRD1OPRK1
SCHEMBL2542693 0.70 DDB1 (0.54) ALDH1A1LMNAAKR1B10AKR1B1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891332-B1 6-PHENYLPYRIDYL-2-AMINE DERIVATIVES PFIZER (US) 2004-03-17 EP disclosed
US-6465491-B2 NITRIC OXIDE SYNTHASE INHIBITOR; NERVOUS SYSTEM DISORDERS PFIZER INC. 2002-10-15 US disclosed
US-20010034348-A1 6-phenylpyridyl-2-amine derivatives LOWE JOHN A (US) 2001-10-25 US disclosed
US-6235747-B1 NITRIC OXIDE SYNTHASE INHIBITOR PFIZER INC. 2001-05-22 US disclosed
EP-0891332-A1 6-PHENYLPYRIDYL-2-AMINE DERIVATIVES PFIZER INC. (US) 1999-01-20 EP disclosed
WO-1997036871-A1 6-PHENYLPYRIDYL-2-AMINE DERIVATIVES PFIZER INC. (US) 1997-10-09 WO 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-20010034348-A1 6-phenylpyridyl-2-amine derivatives NOS2, NOS3, NOS1 CHRM5 207/4885CHRM1 228/4885CHRM3 150/4885

“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.