SCHEMBL23879484

SCHEMBL23879484

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nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
FAAH O00519 1/20 0.40
MAPK1 P28482 1/20 0.40
TSHR P16473 2/20 0.38
ALDH1A1 P00352 6/20 0.36
MAPT P10636 1/20 0.36
CHRM5 P08912 1/20 0.33
CHRM3 P20309 1/20 0.33
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MME P08473 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
EPHX1 P07099 1/20 0.31
ASAH2 Q9NR71 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL16664145 1.00 MEN1 (0.40) MEN1KMT2AFAAHMAPK1TSHR
SCHEMBL25063463 0.85 TAS1R3 (0.42) MEN1KMT2AFAAHMAPK1TSHR
SCHEMBL19522400 0.83 TSHR (0.36) MEN1KMT2AFAAHMAPK1TSHR
SCHEMBL19522458 0.83 TSHR (0.36) MEN1KMT2AFAAHMAPK1TSHR
SCHEMBL23879485 0.83 HDAC2 (0.43) MEN1KMT2AFAAHMAPK1TSHR
SCHEMBL10257664 0.83 TSHR (0.36) MEN1KMT2AFAAHMAPK1TSHR
SCHEMBL19522452 0.83 TSHR (0.36) MEN1KMT2AFAAHMAPK1TSHR
SCHEMBL22294481 0.82 ALDH1A1 (0.33) MEN1KMT2ATSHRALDH1A1MAPT
SCHEMBL22294295 0.82 ALDH1A1 (0.33) MEN1KMT2ATSHRALDH1A1MAPT
SCHEMBL22294369 0.82 ALDH1A1 (0.33) MEN1KMT2ATSHRALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11136327-B2 Macrocycles as factor XIA inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2021-10-05 US 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-11136327-B2 Macrocycles as factor XIA inhibitors TFPI, TFPI2, F11 MEN1 376/4885KMT2A 1111/4885FAAH 1891/4885

“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.