SCHEMBL14744326

SCHEMBL14744326

N#Cc1cc(N)cc(F)c1Br

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KHK P50053 1/20 0.39
CYP11B1 P15538 2/20 0.37
CYP11B2 P19099 2/20 0.37
TRPV4 Q9HBA0 3/20 0.36
EGLN2 Q96KS0 5/20 0.36
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 2/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.34
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
MAPT P10636 3/20 0.33
HPGD P15428 2/20 0.33
GAA P10253 1/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL31588114 0.78 KHK (0.41) KHKCYP11B1CYP11B2TRPV4EGLN2
SCHEMBL2651893 0.78 TRPV4 (0.39) KHKCYP11B1CYP11B2TRPV4ESR1
SCHEMBL504980 0.78 KHK (0.41) KHKCYP11B1CYP11B2TRPV4EGLN2
SCHEMBL238421 0.77 KDM1A (0.44) ALDH1A1MAPTGAACYP3A4KDM1A
SCHEMBL20095956 0.75 CYP11B1 (0.37) KHKCYP11B1CYP11B2TRPV4EGLN2
SCHEMBL14744340 0.75 CYP3A4 (0.41) KHKTRPV4KDM4EALDH1A1USP2
SCHEMBL21051816 0.75 KDM4E (0.40) EGLN2KDM4EALDH1A1USP2LMNA
SCHEMBL22119927 0.75 KHK (0.39) KHKCYP11B1CYP11B2TRPV4EGLN2
SCHEMBL20095954 0.72 TRPV4 (0.34) KHKCYP11B1CYP11B2TRPV4ESR1
SCHEMBL20329648 0.71 TRPV4 (0.33) CYP11B1CYP11B2TRPV4ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025133915-A1 COMPOUNDS WHICH BIND TO PNPLA3I148M AND THEIR USE TO TREAT LIVER DISEASES NOVARTIS AG (CH) 2025-06-26 WO disclosed
US-20190177284-A1 TETRAZOLYL-CONTAINING CYCLOPROPANECARBOXAMIDES Bayer Pharma AG (DE) 2019-06-13 US disclosed
US-20190177284-A1 TETRAZOLYL-CONTAINING CYCLOPROPANECARBOXAMIDES Bayer Pharma AG (DE) 2019-06-13 US disclosed
WO-2013029338-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-03-07 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 (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-20190177284-A1 TETRAZOLYL-CONTAINING CYCLOPROPANECARBOXAMIDES GAP43, PSEN1, PSEN2 KHK 4411/4885CYP11B1 846/4885CYP11B2 395/4885

“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.