SCHEMBL25801975

SCHEMBL25801975

C=C(Cc1nc(-c2ccc(C(F)(F)CC)cc2)no1)C(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 4/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ KLF5 Q13887 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ CYP1A2 P05177 2/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ GSTP1 P09211 4/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ MAPT P10636 4/20 0.41
▸ HDAC1 Q13547 4/20 0.41
▸ HDAC2 Q92769 3/20 0.41
▸ HDAC8 Q9BY41 3/20 0.41
▸ PKM P14618 1/20 0.40
▸ XBP1 P17861 1/20 0.40
▸ FFAR1 O14842 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
SCHEMBL25802075 0.92 TP53 (0.42) TP53SMN1; SMN2RAB9AKLF5LMNA
SCHEMBL23588349 0.90 TP53 (0.41) TP53SMN1; SMN2RAB9AKLF5LMNA
SCHEMBL23578443 0.86 TP53 (0.45) TP53SMN1; SMN2RAB9AKLF5LMNA
SCHEMBL25802137 0.85 MAPT (0.50) SMN1; SMN2LMNAHPGDALDH1A1TSHR
SCHEMBL25802125 0.84 MEN1 (0.46) TP53SMN1; SMN2RAB9AKLF5LMNA
SCHEMBL25807565 0.84 TP53 (0.42) TP53SMN1; SMN2RAB9AKLF5LMNA
SCHEMBL25801756 0.84 TSHR (0.55) SMN1; SMN2RAB9ALMNANPC1CYP1A2
SCHEMBL25802130 0.84 TP53 (0.42) TP53SMN1; SMN2RAB9AKLF5LMNA
SCHEMBL23578358 0.83 TP53 (0.40) TP53SMN1; SMN2RAB9AKLF5LMNA
SCHEMBL25801979 0.82 S1PR4 (0.44) TP53SMN1; SMN2RAB9AKLF5LMNA

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-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES SITRYX THERAPEUTICS LIMITED (GB) 2023-07-13 — — US disclosed
EP-4081511-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMMATORY PROPERTIES Sitryx Therapeutics Limited (GB) 2022-11-02 — — EP 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-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES CPA2, RO60, C5AR1 TP53 2221/4885SMN1; SMN2 3151/4885RAB9A 1795/4885

“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.

Send feedback