SCHEMBL5733271

SCHEMBL5733271

COc1ccc(C(C)(C)C)cc1CC(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.64
NR1H4 Q96RI1 4/20 0.56
CYP2C19 P33261 1/20 0.50
MEN1 O00255 1/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48
GAA P10253 3/20 0.47
NPSR1 Q6W5P4 1/20 0.47
RXRA P19793 2/20 0.46
RXRB P28702 2/20 0.46
ALDH1A1 P00352 3/20 0.44
TSHR P16473 1/20 0.44
NFKB1 P19838 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
RXRG P48443 1/20 0.43
PPARG P37231 1/20 0.43
PPARD Q03181 1/20 0.43
PPARA Q07869 1/20 0.43

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
SCHEMBL3621461 0.87 NR1H4 (0.67) HSD17B10NR1H4CYP2C19MEN1HTT
SCHEMBL20576559 0.86 HSD17B10 (0.62) HSD17B10RXRARXRBRXRGPPARD
SCHEMBL31306759 0.86 HSD17B10 (0.62) HSD17B10RXRARXRBRXRGPPARD
SCHEMBL7854190 0.81 KMT2A (0.47) CYP2C19MEN1HTTKMT2ANPSR1
SCHEMBL18050385 0.80 CYP2C19 (0.44) HSD17B10NR1H4CYP2C19MEN1HTT
SCHEMBL3207839 0.80 MEN1 (0.46) CYP2C19MEN1HTTKMT2AALDH1A1
SCHEMBL7795903 0.80 CYP2D6 (0.59) HSD17B10NR1H4CYP2C19MEN1KMT2A
SCHEMBL11599008 0.78 RXRA (0.56) NR1H4CYP2C19RXRARXRBLMNA
SCHEMBL6343545 0.78 HSD17B10 (0.70) HSD17B10MEN1HTTKMT2AGAA
SCHEMBL13205866 0.78 HSD17B10 (0.70) HSD17B10GAANPSR1ALDH1A1TSHR

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260144743-A1 COMPOUNDS TMEM16A LIMITED (GB) 2026-05-28 US disclosed
EP-4699655-A2 COMPOUNDS TMEM16A LIMITED (GB) 2026-02-25 EP disclosed
US-12377105-B2 Compounds TMEM16A LIMITED (GB) 2025-08-05 US disclosed
CN-119490451-A Compounds as positive modulators of calcium activated chloride channels TMEM16A有限公司 2025-02-21 CN disclosed
CN-111683926-B Compounds of formula (I) 企业治疗学有限公司 2024-11-08 CN disclosed
EP-4215520-A1 TMEM16A MODULATORS TMEM16A LIMITED (GB) 2023-07-26 EP disclosed
EP-3743406-B9 TMEM16A MODULATORS TMEM16A LTD (GB) 2023-03-08 EP disclosed
EP-3743406-B1 TMEM16A MODULATORS TMEM16A LTD (GB) 2022-12-28 EP disclosed
US-20220395512-A1 COMPOUNDS TMEM16A LTD (GB) 2022-12-15 US disclosed
US-11364246-B2 Compounds TMEM16A LIMITED (GB) 2022-06-21 US disclosed
EP-1466906-A1 Heterocyclic urea and related compounds useful as anti-inflammatory agents BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2004-10-13 EP disclosed
US-20040019038-A1 Compounds useful as anti-inflammatory agents BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-01-29 US disclosed
US-6660732-B2 Compounds useful as anti-inflammatory agents BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2003-12-09 US disclosed
US-20030225077-A1 Intermediate arylamine compounds BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2003-12-04 US disclosed
US-6656933-B2 Novel compounds which inhibit production of cytokines involved in inflammatory processes BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2003-12-02 US disclosed
US-20020082256-A1 Compounds useful as anti-inflammatory agents BETAGERI RAJASHEHAR (US) 2002-06-27 US disclosed
US-20020055507-A1 Compounds useful as anti-inflammatory agents BETAGERI RAJASHEHAR (US) 2002-05-09 US disclosed
US-6358945-B1 CYTOKINE, TUMOR NECROSIS FACTOR, AND INTERLEUKIN INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2002-03-19 US disclosed
EP-1165516-A2 HETEROCYCLIC UREA AND RELATED COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2002-01-02 EP disclosed
WO-2000055139-A2 HETEROCYCLIC UREA AND RELATED COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2000-09-21 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 (8 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-20260144743-A1 COMPOUNDS CACNA1E, TMEM109, CACNA1C HSD17B10 868/4885NR1H4 1840/4885CYP2C19 2243/4885
US-11364246-B2 Compounds CACNA1E, TMEM109, CACNA1A HSD17B10 2679/4885NR1H4 2677/4885CYP2C19 2982/4885
US-20030225077-A1 Intermediate arylamine compounds AHR, AADAC, NAT1 HSD17B10 967/4885NR1H4 138/4885CYP2C19 123/4885
US-20220395512-A1 COMPOUNDS CACNA1E, TMEM109, CACNA1A HSD17B10 2273/4885NR1H4 2976/4885CYP2C19 2789/4885
US-20020082256-A1 Compounds useful as anti-inflammatory agents NFKBIA, TNF, MPO HSD17B10 1561/4885NR1H4 214/4885CYP2C19 1588/4885
US-20020055507-A1 Compounds useful as anti-inflammatory agents NFKBIA, TNF, MPO HSD17B10 1561/4885NR1H4 214/4885CYP2C19 1588/4885
US-20040019038-A1 Compounds useful as anti-inflammatory agents NFKBIA, TNF, MPO HSD17B10 1561/4885NR1H4 214/4885CYP2C19 1588/4885
US-12377105-B2 Compounds CACNA1E, TMEM109, CACNA1A HSD17B10 2273/4885NR1H4 2976/4885CYP2C19 2789/4885

“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.