SCHEMBL22324924

SCHEMBL22324924

O=C1CCCN1Cc1ccc(C2CCN(c3ccn[nH]3)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
LTA4H P09960 1/20 0.43
HRH3 Q9Y5N1 1/20 0.41
GRIA2 P42262 3/20 0.40
KCNH2 Q12809 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
ACHE P22303 1/20 0.38
ACACB O00763 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
PARP1 P09874 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
SCHEMBL22324961 0.83 GRIA2 (0.42) HRH3GRIA2CYP1A2CYP2C9CHRM2
SCHEMBL22324871 0.81 SMN1; SMN2 (0.48) HRH3
SCHEMBL22324765 0.79 L3MBTL1 (0.42) L3MBTL1LTA4HHRH3GRIA2KCNH2
SCHEMBL22324948 0.77 L3MBTL1 (0.52) L3MBTL1LTA4HHRH3GRIA2CYP1A2
SCHEMBL22325007 0.75 DRD2 (0.45) CYP1A2CYP2C9
SCHEMBL22325050 0.74 GRM2 (0.35) HRH3
SCHEMBL22340239 0.73 ALDH1A1 (0.44)
SCHEMBL22325008 0.73 ALDH1A1 (0.44) L3MBTL1CYP1A2CYP2C9
SCHEMBL22324979 0.72 DHFR (0.43) CYP1A2CYP2C9
SCHEMBL22325004 0.72 LMNA (0.59)

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 4595/4885LTA4H 66/4885HRH3 2749/4885
US-12479816-B2 20-HETE formation inhibitors CYP4A22, ALOX5, ALOX15 L3MBTL1 4595/4885LTA4H 66/4885HRH3 2749/4885

“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.