SCHEMBL31174643

SCHEMBL31174643

O=C(CC(F)(F)F)c1cccc(Cl)c1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 2/20 0.41
CYP11B1 P15538 2/20 0.40
CYP11B2 P19099 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
P2RX7 Q99572 4/20 0.39
ERCC5 P28715 2/20 0.39
FEN1 P39748 2/20 0.39
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
TSHR P16473 1/20 0.39
AKR1B1 P15121 1/20 0.39
P2RX1 P51575 1/20 0.38
P2RX4 Q99571 1/20 0.38
TMPRSS4 Q9NRS4 1/20 0.38
CES2 O00748 2/20 0.38
CES1 P23141 2/20 0.38
CHRM1 P11229 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL26599128 1.00 KAT6A (0.41) KAT6ACYP11B1CYP11B2MEN1KMT2A
SCHEMBL30606598 0.79 F2R (0.46) CES2CES1ALDH1A1BCHE
SCHEMBL26599129 0.79 F2R (0.46) CES2CES1ALDH1A1BCHE
SCHEMBL4304964 0.79 PTPN1 (0.49) KAT6ACYP11B1CYP11B2MEN1KMT2A
SCHEMBL5158721 0.79 KAT6A (0.43) KAT6ACYP11B1CYP11B2MEN1KMT2A
SCHEMBL29738218 0.79 PTPN1 (0.49) KAT6ACYP11B1CYP11B2MEN1KMT2A
SCHEMBL31500342 0.79 KAT6A (0.43) KAT6ACYP11B1CYP11B2MEN1KMT2A
SCHEMBL26599005 0.77 KAT6A (0.44) KAT6ACYP11B1CYP11B2P2RX7TSHR
SCHEMBL15771164 0.76 KAT6A (0.41) KAT6ACYP11B1CYP11B2MEN1KMT2A
SCHEMBL30440405 0.75 MAPT (0.48) KAT6ACYP11B1CYP11B2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250339402-A1 EFFECTIVE MEANS TO MODULATE NMDA RECEPTOR-MEDIATED TOXICITY FUNDAMENTAL PHARMA GMBH (DE) 2025-11-06 US disclosed
WO-2024223617-A1 EFFECTIVE MEANS TO MODULATE NMDA RECEPTOR-MEDIATED TOXICITY FUNDAMENTAL PHARMA GMBH (DE) 2024-10-31 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-20250339402-A1 EFFECTIVE MEANS TO MODULATE NMDA RECEPTOR-MEDIATED TOXICITY TRPM4, GRM4, GRIN1 KAT6A 1584/4885CYP11B1 3790/4885CYP11B2 3974/4885

“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.