SCHEMBL22324765

SCHEMBL22324765

O=C1CCCN1Cc1ccc(C2CCN(c3cn[nH]c3)CC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
GRIA2 P42262 4/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
LTA4H P09960 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
ACACB O00763 1/20 0.40
KCNH2 Q12809 1/20 0.39
CYP2D6 P10635 1/20 0.38
HSD11B1 P28845 2/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37

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
SCHEMBL22324917 0.86 EPHX2 (0.36) GRIA2CYP1A2CYP2C9KCNH2CYP2D6
SCHEMBL22324883 0.84 GRIA2 (0.44) GRIA2CYP1A2CYP2C9
SCHEMBL22324830 0.84 GRIA2 (0.38) L3MBTL1GRIA2CYP1A2CYP2C9HRH3
SCHEMBL22324890 0.82 SMN1; SMN2 (0.48) L3MBTL1HRH3HSD11B1
Hydrochloric Acid SCHEMBL22325037 0.81 SMN1; SMN2 (0.47) L3MBTL1HRH3HSD11B1
SCHEMBL22324924 0.79 L3MBTL1 (0.43) L3MBTL1GRIA2CYP1A2CYP2C9LTA4H
SCHEMBL22325002 0.76 HRH3 (0.46) L3MBTL1LTA4HHRH3
SCHEMBL22324948 0.76 L3MBTL1 (0.52) L3MBTL1GRIA2CYP1A2CYP2C9LTA4H
SCHEMBL22324860 0.76 DRD2 (0.44) KCNH2
SCHEMBL22340524 0.76 GRM2 (0.35) HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12479816-B2 20-HETE formation inhibitors University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2025-11-25 US disclosed
US-20220144797-A1 20-HETE FORMATION INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2022-05-12 US disclosed
US-20220144797-A1 20-HETE FORMATION INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2022-05-12 US disclosed
WO-2020163689-A1 20-HETE FORMATION INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2020-08-13 WO disclosed
WO-2020163689-A1 20-HETE FORMATION INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2020-08-13 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 (2 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-20220144797-A1 20-HETE FORMATION INHIBITORS CYP4A22, ALOX5, ALOX15 L3MBTL1 4595/4885GRIA2 1400/4885CYP1A2 41/4885
US-12479816-B2 20-HETE formation inhibitors CYP4A22, ALOX5, ALOX15 L3MBTL1 4595/4885GRIA2 1400/4885CYP1A2 41/4885

“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.