SCHEMBL23588349

SCHEMBL23588349

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

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ KLF5 Q13887 1/20 0.41
▸ HDAC1 Q13547 3/20 0.40
▸ HDAC2 Q92769 3/20 0.40
▸ HDAC8 Q9BY41 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ GSTP1 P09211 4/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ CYP1A2 P05177 2/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ TSHR P16473 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 0.94 TP53 (0.42) TP53SMN1; SMN2RAB9AKLF5HDAC1
SCHEMBL25801975 0.90 TP53 (0.43) TP53SMN1; SMN2RAB9AKLF5HDAC1
SCHEMBL23578048 0.87 HDAC2 (0.43) TP53SMN1; SMN2RAB9AKLF5HDAC1
SCHEMBL23578363 0.85 KMT2A (0.35) LMNAALDH1A1TSHR
SCHEMBL23588077 0.84 ACACB (0.52) TP53SMN1; SMN2RAB9ALMNANPC1
SCHEMBL23588102 0.84 SPHK1 (0.48) TP53SMN1; SMN2RAB9AKLF5LMNA
SCHEMBL23588271 0.83 SPHK1 (0.53) —
SCHEMBL25802137 0.81 MAPT (0.50) SMN1; SMN2HDAC1HDAC2HDAC8LMNA
SCHEMBL25801979 0.81 S1PR4 (0.44) TP53SMN1; SMN2RAB9AKLF5HDAC1
SCHEMBL25801985 0.81 HDAC8 (0.43) TP53SMN1; SMN2RAB9AKLF5HDAC1

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
US-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES SITRYX THERAPEUTICS LIMITED (GB) 2023-07-13 — — US disclosed
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
WO-2021130492-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMMATORY PROPERTIES SITRYX THERAPEUTICS LIMITED (GB) 2021-07-01 — — 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-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.

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