SCHEMBL697605

SCHEMBL697605

CC(C(=O)Cl)C1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.39
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
MMP2 P08253 2/20 0.38
CA9 Q16790 2/20 0.38
ATM Q13315 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.33
ALDH1A1 P00352 2/20 0.33
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
TSHR P16473 1/20 0.33
DPP4 P27487 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL1594522 0.98 EPHX1 (0.43) EPHX1CA12CA1CA2MMP2
SCHEMBL971123 0.98 EPHX1 (0.43) EPHX1CA12CA1CA2MMP2
SCHEMBL27923565 0.95
SCHEMBL745881 0.90
SCHEMBL27713854 0.79 EPHX1 (0.42) EPHX1CA12CA1CA2MMP2
SCHEMBL7494708 0.78 CPN1 (0.47) ATMSMN1; SMN2TSHR
SCHEMBL17628753 0.77 ACE (0.43) EPHX1CA12CA1CA2MMP2
SCHEMBL417582 0.77 ACE (0.43) EPHX1CA12CA1CA2MMP2
SCHEMBL1572997 0.77 EPHX1 (0.41) EPHX1CA12CA1CA2MMP2
SCHEMBL9307 0.77 ACE (0.43) EPHX1CA12CA1CA2MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114957156-A Compound containing benzoxazine structure, resin composition, prepreg and electric copper clad laminate, and preparation method and application thereof 成都科宜高分子科技有限公司 2022-08-30 CN claimed
CN-115785124-B KRAS G12D inhibitors and uses thereof 润佳(苏州)医药科技有限公司 2024-11-08 CN disclosed
CN-117986232-A Oxime ester photoinitiator, preparation method and application thereof 常州强力电子新材料股份有限公司 2024-05-07 CN disclosed
CN-116284055-A KRAS inhibitor and application thereof 润佳(苏州)医药科技有限公司 2023-06-23 CN disclosed
CN-115785124-A KRAS G12D inhibitors and uses thereof 润佳(苏州)医药科技有限公司 2023-03-14 CN disclosed
CN-114957156-A Compound containing benzoxazine structure, resin composition, prepreg and electric copper clad laminate, and preparation method and application thereof 成都科宜高分子科技有限公司 2022-08-30 CN disclosed
CN-111320714-B Oxime ester photoinitiator, preparation method and application thereof 常州强力先端电子材料有限公司 2022-04-19 CN disclosed
CN-111320714-A Oxime ester photoinitiator, preparation method and application thereof 常州强力先端电子材料有限公司 2020-06-23 CN disclosed
CN-109629026-A A kind of cellulose melt spun fibre and preparation method thereof with durable antibiotic performance 东华大学 2019-04-16 CN disclosed
CN-108329828-A Resistance to ag(e)ing, water resistance, oil resistivity Water-based ceramic-imitating coating and preparation method thereof 段宝荣 2018-07-27 CN disclosed
US-4661512-A Adamantanamine derivatives, processes for their preparation and drugs in which they are present S. A. PANMEDICA (FR) 1987-04-28 US disclosed
US-4242334-A ANTIINFLAMMATORY AGENTS; SKIN DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1980-12-30 US disclosed
US-4178381-A C-homoestratrienes SCHERING, AKTIENGESELLSCHAFT (DE) 1979-12-11 US disclosed
US-4124707-A 7α-Halogeno-3,20-dioxo-1,4-pregnadienes, methods for their manufacture, their use as anti-inflammatory agents, and pharmaceutical formulations useful therefor SCHERING CORPORATION (US) 1978-11-07 US disclosed
US-4097496-A ANTIPROSTAGLANDIN ACTIVITY HOECHST AKTIENGESELLSCHAFT (DT) 1978-06-27 US disclosed
US-4076708-A Process for the preparation of 7α-halogeno-3-oxo-4-dehydro steroids and novel 7α-halogeno derivatives produced thereby SCHERING CORPORATION (US) 1978-02-28 US disclosed
US-4038299-A ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC SYNTEX (U.S.A.) INC. (US) 1977-07-26 US disclosed
US-3984459-A ANTI-PROSTAGLANDINS HOECHST AKTIENGESELLSCHAFT (DT) 1976-10-05 US disclosed
US-3966820-A ANALGESICS, ANTIINFLAMMATORY, ANTIPYRETICS SYNTEX (U.S.A.) INC. (US) 1976-06-29 US disclosed
US-3950408-A Process for preparing [1-oxo-2-cyclopentyl (or 2-isopropyl)-2-methyl-6,7-dichloro-5-indanyloxy] acetic acid MERCK & CO., INC. (US) 1976-04-13 US disclosed