SCHEMBL23176754

SCHEMBL23176754

COC(=O)c1ccc(N(C)C(=O)[C@H](C)Cc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.52
▸ ROCK2 O75116 1/20 0.48
▸ NOTUM Q6P988 1/20 0.48
▸ CA1 P00915 1/20 0.48
▸ CA2 P00918 1/20 0.48
▸ ALDH1A1 P00352 4/20 0.47
▸ MAPT P10636 2/20 0.47
▸ TSHR P16473 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ GPR88 Q9GZN0 1/20 0.46
▸ SENP1 Q9P0U3 1/20 0.45
▸ CYP3A4 P08684 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ HDAC1 Q13547 1/20 0.44

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
SCHEMBL28712598 0.86 ROCK2 (0.47) HPGDROCK2NOTUMCA1CA2
SCHEMBL24986138 0.86 ROCK2 (0.47) HPGDROCK2NOTUMCA1CA2
SCHEMBL18325693 0.84 HPGD (0.66) HPGDALDH1A1TSHRRAB9ANPC1
SCHEMBL13921984 0.82 NOTUM (0.54) HPGDROCK2NOTUMCA1CA2
SCHEMBL2600694 0.76 ALDH1A1 (0.60) HPGDCA2ALDH1A1MAPTTSHR
SCHEMBL17761604 0.76 ALDH1A1 (0.60) HPGDCA2ALDH1A1MAPTTSHR
SCHEMBL517463 0.76 ALDH1A1 (0.60) HPGDCA2ALDH1A1MAPTTSHR
SCHEMBL2831110 0.76 MLYCD (0.57) HPGDROCK2NOTUMCA1CA2
SCHEMBL13577833 0.75 LOXL2 (0.56) CA1CA2MAPTTSHRRAB9A
SCHEMBL23582892 0.75 LOXL2 (0.56) CA1CA2MAPTTSHRRAB9A

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-20230027295-A1 FXIA INHIBITORS AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF SHENZHEN SALUBRIS PHARMACEUTICALS CO., LTD. (CN) 2023-01-26 — — US disclosed
WO-2021057818-A1 FXIA INHIBITORS AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF 深圳信立泰药业股份有限公司 2021-04-01 — — 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-20230027295-A1 FXIA INHIBITORS AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF F11, TFPI, F7 HPGD 1092/4885ROCK2 286/4885NOTUM 45/4885

“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.

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