SCHEMBL936362

SCHEMBL936362

COC(=O)C(Br)CC(C)C

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.48
MME P08473 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
TAS1R3 Q7RTX0 4/20 0.39
TAS1R1 Q7RTX1 4/20 0.39
CA14 Q9ULX7 2/20 0.37
BIRC2 Q13490 1/20 0.37
POLB P06746 1/20 0.37
FOLH1 Q04609 1/20 0.36
CA12 O43570 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
RNPEP Q9H4A4 1/20 0.34

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
SCHEMBL29038034 1.00 ZDHHC7 (0.48) ZDHHC7MMESMN1; SMN2TAS1R3TAS1R1
SCHEMBL1415280 0.87 ZDHHC7 (0.54) ZDHHC7MMESMN1; SMN2CA14CA12
SCHEMBL6683720 0.86 ZDHHC7 (0.48) ZDHHC7MMESMN1; SMN2TAS1R3TAS1R1
SCHEMBL106430 0.84 ZDHHC7 (0.47) ZDHHC7MMESMN1; SMN2TAS1R3TAS1R1
SCHEMBL22162842 0.82 ZDHHC7 (0.46) ZDHHC7MMESMN1; SMN2TAS1R3TAS1R1
SCHEMBL22162843 0.82 ZDHHC7 (0.46) ZDHHC7MMESMN1; SMN2TAS1R3TAS1R1
SCHEMBL19998323 0.80 ZDHHC7 (0.41) ZDHHC7MMETAS1R3TAS1R1BIRC2
SCHEMBL30520135 0.79 ALDH1A1 (0.40) ZDHHC7SMN1; SMN2POLBRNPEP
SCHEMBL1370661 0.79 ALDH1A1 (0.40) ZDHHC7SMN1; SMN2POLBRNPEP
SCHEMBL27575981 0.79 ZDHHC7 (0.47) ZDHHC7MMESMN1; SMN2CA14FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025124544-A1 3,4-DIHYDRO-2H-BENZO[B][1,4]DIOXEPANE COMPOUND, AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF 华润医药研究院(深圳)有限公司 2025-06-19 WO disclosed
EP-4559525-A2 INHIBITING HUMAN INTEGRIN ALPHA4BETA7 Morphic Therapeutic, Inc. (US) 2025-05-28 EP disclosed
EP-4045039-B1 INHIBITING HUMAN INTEGRIN ALPHA4BETA7 MORPHIC THERAPEUTIC INC (US) 2025-04-23 EP disclosed
US-20250084044-A1 PROTOPORPHYRINOGEN OXIDASE INHIBITORS ENKO CHEM, INC. (US) 2025-03-13 US disclosed
CN-119192137-A Inhibition of human integrin alpha4β7 莫菲克医疗股份有限公司 2024-12-27 CN disclosed
EP-4462999-A1 PROTOPORPHYRINOGEN OXIDASE INHIBITORS Enko Chem, Inc. (US) 2024-11-20 EP disclosed
CN-118541030-A Protoporphyrinogen oxidase inhibitors 恩科化学公司 2024-08-23 CN disclosed
US-20240174632-A1 INHIBITING HUMAN INTEGRIN (ALPHA-4) (BETA-7) MORPHIC THERAPEUTIC, INC. (US) 2024-05-30 US disclosed
WO-2023137307-A1 PROTOPORPHYRINOGEN OXIDASE INHIBITORS ENKO CHEM, INC. (US) 2023-07-20 WO disclosed
CN-116425682-A Pyrimidine-1 (2H) -oxo compound and preparation method and application thereof 深圳信立泰药业股份有限公司 2023-07-14 CN disclosed
US-4945092-A Substituted 1-(oxopyrrolidinylalkanoyl)-piperazines useful as nootropics CIBA-GEIGY CORPORATION (US) 1990-07-31 US disclosed
EP-0185380-B1 THIOL BASED COLLAGENASE INHIBITORS G.D. Searle & Co. (US) 1990-04-11 EP disclosed
US-4681966-A ANTIARTHRITIC AGENTS G. D. SEARLE & CO. (US) 1987-07-21 US disclosed
EP-0185380-A2 Thiol based collagenase inhibitors G.D. Searle & Co. (US) 1986-06-25 EP disclosed
US-4595700-A Thiol based collagenase inhibitors G. D. SEARLE & CO. (US) 1986-06-17 US disclosed
US-4593098-A Piperazinone and piperazine polypeptides THE UPJOHN COMPANY (US) 1986-06-03 US disclosed
US-4534897-A Piperazinone, piperazine, 1,4-diazepin-2-one and 1,4-diazepine intermediate compounds THE UPJOHN COMPANY (US) 1985-08-13 US disclosed
US-4251438-A ANALGESICS, PSYCHOTHERAPEUTIC AGENTS THE UPJOHN COMPANY (US) 1981-02-17 US disclosed
US-4234744-A Process for the production of aminoacid hydrochlorides/or diaminoacid dihydrochlorides DEUTSCHE GOLD- UND SILBER SCHEIDEANSTALT VORMALS ROESSLER (DE) 1980-11-18 US disclosed
US-3996940-A Tobacco product R. J. REYNOLDS TOBACCO COMPANY (US) 1976-12-14 US 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 (2 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-20250084044-A1 PROTOPORPHYRINOGEN OXIDASE INHIBITORS PPOX, CYP4X1, PNPO ZDHHC7 2447/4885MME 3379/4885SMN1; SMN2 4863/4885
US-20240174632-A1 INHIBITING HUMAN INTEGRIN (ALPHA-4) (BETA-7) ITGB7, ITGB4, ITGA4 ZDHHC7 734/4885MME 1380/4885SMN1; SMN2 2204/4885

“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.