SCHEMBL23707828

SCHEMBL23707828

CCC[C@H]1CC[C@@H](CN)CC1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.44
LMNA P02545 3/20 0.41
PLG P00747 1/20 0.41
PLAT P00750 1/20 0.41
CYP2C9 P11712 1/20 0.39
NOS3 P29474 6/20 0.39
NOS1 P29475 6/20 0.39
NOS2 P35228 6/20 0.39
CYP1A2 P05177 1/20 0.39
MAPK1 P28482 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HTT P42858 1/20 0.36
FYN P06241 1/20 0.32

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
SCHEMBL15537284 1.00 NCF1 (0.44) NCF1LMNAPLGPLATCYP2C9
SCHEMBL17268183 1.00 NCF1 (0.44) NCF1LMNAPLGPLATCYP2C9
Hydrochloric Acid SCHEMBL17260637 0.97 NCF1 (0.42) NCF1LMNAPLGPLATCYP2C9
Ethylamine SCHEMBL7195532 0.88
Propylamine SCHEMBL29170833 0.86 CYP2C9 (0.40) LMNACYP2C9NOS3NOS1NOS2
Methylamine SCHEMBL7186567 0.85
SCHEMBL129995 0.85
SCHEMBL5691374 0.85 CYP1A2 (0.48) LMNACYP2C9NOS3NOS1NOS2
SCHEMBL17592348 0.84 CYP1A2 (0.58) NCF1LMNAPLGPLATNOS3
SCHEMBL17592419 0.84 CYP1A2 (0.58) NCF1LMNAPLGPLATNOS3

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-20210236474-A1 IMIDAZO[4,5-C]PYRIDINE COMPOUNDS AS LSD-1 INHIBITORS UNIV MICHIGAN REGENTS (US) 2021-08-05 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-20210236474-A1 IMIDAZO[4,5-C]PYRIDINE COMPOUNDS AS LSD-1 INHIBITORS KDM1A, KDM4A, KDM1B NCF1 2944/4885LMNA 1804/4885PLG 4640/4885

“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.