SCHEMBL4747804

SCHEMBL4747804

O=C1CCCN1Cc1ccc(Br)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.50
MAPK1 P28482 1/20 0.48
P2RX7 Q99572 4/20 0.47
ALDH1A1 P00352 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.44
HRH3 Q9Y5N1 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
POLB P06746 2/20 0.40
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.39
EPHX2 P34913 1/20 0.39

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
SCHEMBL30798198 0.85 KMT2A (0.57) KMT2AMAPK1P2RX7ALDH1A1SMN1; SMN2
SCHEMBL1424192 0.82 BDKRB1 (0.50) KMT2AMAPK1P2RX7L3MBTL1POLB
SCHEMBL17184830 0.82 KMT2A (0.48) KMT2AMAPK1L3MBTL1HRH3POLB
SCHEMBL17184827 0.79 KDM4E (0.50) KMT2AMAPK1P2RX7TDP1ADRA1D
SCHEMBL16759677 0.78 ALDH1A1 (0.65) KMT2AMAPK1P2RX7ALDH1A1SMN1; SMN2
SCHEMBL6824717 0.78 L3MBTL1 (0.65) KMT2AMAPK1L3MBTL1HRH3POLB
SCHEMBL3169070 0.77 KMT2A (0.48) KMT2AMAPK1L3MBTL1HRH3SMN1; SMN2
SCHEMBL16891466 0.74 L3MBTL1 (0.70) KMT2AALDH1A1L3MBTL1HRH3SMN1; SMN2
SCHEMBL2107836 0.74 TSHR (0.58) KMT2AALDH1A1L3MBTL1SMN1; SMN2POLB
SCHEMBL22324823 0.74 ALDH1A1 (0.44) KMT2AMAPK1ALDH1A1L3MBTL1HRH3

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 7 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
WO-2008110566-A1 COMPOUNDS WHICH POTENTIATE AMPA RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LIMITED (GB) 2008-09-18 WO disclosed
WO-2008110566-A1 COMPOUNDS WHICH POTENTIATE AMPA RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LIMITED (GB) 2008-09-18 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 KMT2A 4424/4885MAPK1 2594/4885P2RX7 2910/4885
US-12479816-B2 20-HETE formation inhibitors CYP4A22, ALOX5, ALOX15 KMT2A 4424/4885MAPK1 2594/4885P2RX7 2910/4885

“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.