SCHEMBL9613490

SCHEMBL9613490

COC(=O)[C@@H]1CC=CCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
MIF P14174 1/20 0.45
ALDH1A1 P00352 2/20 0.45
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
ALOX15 P16050 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.45
ESR2 Q92731 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TP53 P04637 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
RAB9A P51151 1/20 0.40
CHRNB2 P17787 2/20 0.38
CHRNA4 P43681 2/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA7 P36544 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
SCHEMBL91215 1.00 TDP1 (0.46) TDP1MIFALDH1A1MEN1MAPT
SCHEMBL11982130 1.00 TDP1 (0.46) TDP1MIFALDH1A1MEN1MAPT
Cyclohexene SCHEMBL704338 0.94 TDP1 (0.43) TDP1MIFALDH1A1MEN1MAPT
SCHEMBL5046323 0.89 TP53 (0.47) ALDH1A1MAPTTP53SMN1; SMN2CHRNB2
SCHEMBL4015650 0.86 SMN1; SMN2 (0.45) TDP1MIFALDH1A1MEN1MAPT
SCHEMBL4015654 0.86 SMN1; SMN2 (0.45) TDP1MIFALDH1A1MEN1MAPT
SCHEMBL637275 0.84
SCHEMBL17889899 0.83
SCHEMBL11536892 0.83 MIF (0.47) TDP1MIFALDH1A1MEN1MAPT
SCHEMBL385399 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119144580-A Carboxylesterase mutant and application thereof in preparation of (S) -3-cyclohexene-1-carboxylic acid 浙江大学 2024-12-17 CN claimed
CN-116355876-A Recombinant esterase mutant, engineering bacterium and application thereof in synthesis of (S) -3-cyclohexene-1-formic acid 浙江工业大学 2023-06-30 CN claimed
US-11441133-B2 Acinetobacter and use thereof in production of chiral 3-cyclohexene-1-carboxylic acid JIANGNAN UNIVERSITY (CN) 2022-09-13 US claimed
WO-2020224232-A1 ACINETOBACTER AND USE THEREOF IN PRODUCTION OF CHIRAL 3-CYCLOHEXENE-1-FORMIC ACID 江南大学 2020-11-12 WO claimed
CN-110272839-B Acinetobacter and application thereof in production of chiral 3-cyclohexene-1-formic acid 江南大学 2020-10-30 CN claimed
WO-2020216295-A1 METHOD FOR RESOLVING OPTICAL ISOMER BY USING SUPERCRITICAL FLUID EXTRACTION TECHNOLOGY 广安摩珈生物科技有限公司 2020-10-29 WO claimed
CN-119899823-A Lipase mutant, coding gene and application 浙江工业大学 2025-04-29 CN disclosed
CN-119899822-A Lipase mutant, coding gene, vector and application 浙江工业大学 2025-04-29 CN disclosed
CN-119876086-A Lipase mutant and application thereof 浙江工业大学 2025-04-25 CN disclosed
CN-119876087-A Lipase mutant and application thereof in preparation of (S) -3-cyclohexene-1-carboxylic acid 浙江工业大学 2025-04-25 CN disclosed
CN-119876088-A Lipase mutant and application thereof in preparation of (S) -3-cyclohexene-1-carboxylic acid 浙江工业大学 2025-04-25 CN disclosed
CN-119639716-A Cyclohexenecarboxylesterase, mutant and application thereof in production of (S) -3-cyclohexene-1-carboxylic acid 浙江工业大学 2025-03-18 CN disclosed
CN-119432809-A Lipase mutant and application thereof 浙江工业大学 2025-02-14 CN disclosed
WO-2020224232-A1 ACINETOBACTER AND USE THEREOF IN PRODUCTION OF CHIRAL 3-CYCLOHEXENE-1-FORMIC ACID 江南大学 2020-11-12 WO disclosed
CN-110272839-B Acinetobacter and application thereof in production of chiral 3-cyclohexene-1-formic acid 江南大学 2020-10-30 CN disclosed
CN-111778229-A Cyclohexene carboxylate hydrolase, mutant thereof, encoding gene, expression vector, recombinant bacterium and application 江南大学 2020-10-16 CN disclosed
CN-106119303-B Method for preparing chiral 3-cyclohexene-1-formic acid by protease resolution 浙江工业大学 2020-02-21 CN disclosed
US-9884830-B2 Synthesis of tetracyclines and analogues thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2018-02-06 US disclosed
US-9624338-B2 Alternating ring-opening metathesis polymerization THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2017-04-18 US disclosed
EP-2457573-A1 Methods of use of glycomimetics with replacements for hexoses and N-Acetyl hexosamines GlycoMimetics, Inc. (US) 2012-05-30 EP disclosed