SCHEMBL22324809

SCHEMBL22324809

c1cnc(SC2CCNCC2)nc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP1A2 P05177 1/20 0.46
CRBN Q96SW2 2/20 0.42
DDB1 Q16531 1/20 0.42
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 1/20 0.35
SLC6A2 P23975 7/20 0.35
SLC6A4 P31645 7/20 0.35
HTR1A P08908 6/20 0.35
SLC6A3 Q01959 4/20 0.35
MAPT P10636 1/20 0.34
PKM P14618 1/20 0.34
ALOX15 P16050 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
SLC18A3 Q16572 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
PLD1 Q13393 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
SCHEMBL21826794 0.80 CRBN (0.42) KMT2ACRBNDDB1ALDH1A1KDM4E
SCHEMBL12949394 0.78 KDM4E (0.42) KMT2ACYP1A2CRBNDDB1ALDH1A1
SCHEMBL4675115 0.77 KMT2A (0.57) MEN1KMT2ACYP1A2CRBNDDB1
Hydrochloric Acid SCHEMBL4706173 0.76 KMT2A (0.55) MEN1KMT2ACYP1A2CRBNDDB1
SCHEMBL9536537 0.75 MEN1 (0.39) MEN1KMT2ACYP1A2
SCHEMBL21047745 0.73 CRBN (0.49) KMT2ACRBNDDB1ALDH1A1
SCHEMBL23687079 0.72 DDB1 (0.33) KMT2ACRBNDDB1ALDH1A1
SCHEMBL19285467 0.72 DDB1 (0.33) KMT2ACRBNDDB1ALDH1A1
SCHEMBL19302136 0.72 DDB1 (0.33) KMT2ACRBNDDB1ALDH1A1
SCHEMBL4670744 0.69 MEN1 (0.45) MEN1KMT2ACYP1A2CRBNDDB1

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 MEN1 4869/4885KMT2A 4424/4885CYP1A2 41/4885
US-12479816-B2 20-HETE formation inhibitors CYP4A22, ALOX5, ALOX15 MEN1 4869/4885KMT2A 4424/4885CYP1A2 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.