SCHEMBL25801756

SCHEMBL25801756

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

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.55
▸ NOTUM Q6P988 2/20 0.51
▸ SIRT2 Q8IXJ6 2/20 0.51
▸ GSTP1 P09211 2/20 0.49
▸ NPC1 O15118 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ MAPT P10636 1/20 0.47
▸ HDAC2 Q92769 1/20 0.47
▸ HDAC8 Q9BY41 1/20 0.47
▸ CYP1A2 P05177 2/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL25802137 0.89 MAPT (0.50) TSHRLMNAMAPTHDAC2HDAC8
SCHEMBL25807565 0.88 TP53 (0.42) TSHRSIRT2NPC1LMNARAB9A
SCHEMBL25802125 0.88 MEN1 (0.46) TSHRSIRT2GSTP1NPC1LMNA
SCHEMBL25802130 0.88 TP53 (0.42) TSHRSIRT2NPC1LMNARAB9A
SCHEMBL30689312 0.86 FPR2 (0.43) TSHRSIRT2GSTP1MAPTSMN1; SMN2
SCHEMBL23578358 0.85 TP53 (0.40) TSHRGSTP1NPC1LMNARAB9A
SCHEMBL23588102 0.84 SPHK1 (0.48) NPC1LMNARAB9AMAPTSMN1; SMN2
SCHEMBL23588107 0.84 MAPT (0.45) TSHRNPC1LMNARAB9AMAPT
SCHEMBL23588077 0.84 ACACB (0.52) NPC1LMNARAB9AMAPTHTT
SCHEMBL25801975 0.84 TP53 (0.43) TSHRGSTP1NPC1LMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4081511-B3 CARBOXY DERIVATIVES WITH ANTIINFLAMMATORY PROPERTIES SITRYX THERAPEUTICS LTD (GB) 2026-03-04 — — EP disclosed
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
CN-115066418-A Carboxy derivatives with anti-inflammatory properties 西特瑞治疗有限公司 2022-09-16 — — CN 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 TSHR 3550/4885NOTUM 1465/4885SIRT2 163/4885

“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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