SCHEMBL25801988

SCHEMBL25801988

C=C(Cc1nc(-c2ccc(CCC3CC3)cc2)no1)C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SPHK1 Q9NYA1 5/20 0.45
▸ RAB9A P51151 3/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ GPR119 Q8TDV5 2/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ TSHR P16473 3/20 0.42
▸ RECQL P46063 1/20 0.42
▸ TP53 P04637 3/20 0.40
▸ FFAR1 O14842 2/20 0.40
▸ KLF5 Q13887 1/20 0.40
▸ CYP2C19 P33261 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ CYP1A2 P05177 2/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ ATM Q13315 2/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HTT P42858 1/20 0.38

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
SCHEMBL23588102 0.86 SPHK1 (0.48) SPHK1RAB9AL3MBTL1SMN1; SMN2TP53
SCHEMBL23578444 0.85 RAB9A (0.50) SPHK1RAB9AL3MBTL1SMN1; SMN2TSHR
SCHEMBL25801979 0.85 S1PR4 (0.44) RAB9ASMN1; SMN2TSHRTP53FFAR1
SCHEMBL23588271 0.85 SPHK1 (0.53) SPHK1
SCHEMBL25802137 0.83 MAPT (0.50) SMN1; SMN2TSHRFFAR1ALDH1A1MAPK1
SCHEMBL25801985 0.82 HDAC8 (0.43) SPHK1RAB9AL3MBTL1SMN1; SMN2TP53
SCHEMBL25801756 0.82 TSHR (0.55) RAB9ASMN1; SMN2TSHRCYP2C19NPC1
SCHEMBL25807565 0.82 TP53 (0.42) RAB9AGPR119SMN1; SMN2TSHRTP53
SCHEMBL25802125 0.82 MEN1 (0.46) RAB9AL3MBTL1GPR119SMN1; SMN2TSHR
SCHEMBL25802130 0.82 TP53 (0.42) RAB9AGPR119SMN1; SMN2TSHRTP53

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 3 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

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 SPHK1 3875/4885RAB9A 1795/4885L3MBTL1 3425/4885

“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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