SCHEMBL612494

SCHEMBL612494

O=C(O)C1CCCCC1=O

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.60
MAPK1 P28482 1/20 0.47
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
KDM4E B2RXH2 2/20 0.43
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP2D6 P10635 1/20 0.37
CYP1A2 P05177 1/20 0.37
RECQL P46063 1/20 0.37
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL3553694 1.00 MCL1 (0.60) MCL1MAPK1CA1CA2CA4
SCHEMBL17178416 0.98 MCL1 (0.58) MCL1MAPK1CA1CA2CA4
SCHEMBL8081259 0.98 MCL1 (0.58) MCL1MAPK1CA1CA2CA4
SCHEMBL7353241 0.98 MCL1 (0.58) MCL1MAPK1CA1CA2CA4
SCHEMBL28677273 0.98 MCL1 (0.58) MCL1MAPK1CA1CA2CA4
Ethane SCHEMBL4053553 0.96 MCL1 (0.56) MCL1MAPK1CA1CA2CA4
SCHEMBL22468834 0.93
SCHEMBL932332 0.93
Ethylene SCHEMBL10582422 0.88 MCL1 (0.48) MCL1MAPK1CA1CA2CA4
Ethane SCHEMBL4051846 0.88 MCL1 (0.48) MCL1MAPK1CA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024049929-A2 PANNEXIN-1 MODULATORS AND METHODS OF TREATING DISORDERS IN WHICH PANNEXIN-1 IS IMPLICATED PANNEX THERAPEUTICS INC. (US) 2024-03-07 WO claimed
CN-113773182-B Method for synthesizing 6, 8-dichloro octanoate 风火轮(上海)生物科技有限公司 2024-02-06 CN claimed
US-11708592-B2 Microorganisms and methods for the production of caprolactone GENOMATICA, INC. (US) 2023-07-25 US claimed
CN-113773182-A Method for synthesizing 6, 8-dichloro caprylic acid ester 风火轮(上海)生物科技有限公司 2021-12-10 CN claimed
CN-107333539-A A kind of basswood cuttage technique for purifying air 合肥同创园林科技有限公司 2017-11-10 CN claimed
CN-107258430-A A kind of beech tree Technique on Cuttage Propagation 合肥同创园林科技有限公司 2017-10-20 CN claimed
CN-107258140-A A kind of seed accelerating germination method of ornamental plantation tree peony 合肥同创园林科技有限公司 2017-10-20 CN claimed
CN-107182505-A A kind of pumila hardwood cuttage method 合肥同创园林科技有限公司 2017-09-22 CN claimed
CN-107173072-A A kind of gardens basswood propagation by grafiting technology 合肥同创园林科技有限公司 2017-09-19 CN claimed
CN-107094507-A A kind of engrafting method of the gold leaf elm of beautifying city 合肥同创园林科技有限公司 2017-08-29 CN claimed
EP-0379911-B1 N-PHENYL TETRAHYDROINDAZOLE DERIVATIVES BASF Aktiengesellschaft (DE) 1992-12-02 EP claimed
EP-0287842-B1 CURABLE COMPOSITIONS CONTAINING A MICHAEL-ADDITION PRODUCT, THEIR PREPARATION AND USE BASF Lacke + Farben AG (DE) 1991-06-12 EP claimed
EP-0257727-B1 PROCESS FOR PREPARING CYCLOHEXANONECARBOXYLIC ACID COMPOUNDS MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-08-30 EP claimed
US-4785132-A CATALYTIC HYDROGENATION OF HYDROXYBENZOIC ACIDS MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1988-11-15 US claimed
EP-0257727-A1 Process for preparing cyclohexanonecarboxylic acid compounds MITSUI TOATSU CHEMICALS, Inc. (JP) 1988-03-02 EP claimed
EP-0134889-B1 CYCLOHEXANE CARBOXYLIC ACIDS AND DERIVATIVES THEREOF AS ANTIDYSRHYTHMIC AGENTS PENNWALT CORPORATION (US) 1987-11-11 EP claimed
EP-0028445-B1 ACRIDINONES, THEIR PREPARATION AND USE; INTERMEDIATES AND THEIR PREPARATION CIBA-GEIGY AG (CH) 1985-10-23 EP claimed
US-4305823-A MODIFIED WITH CYCLIC B-KETONIC ACIDS CIBA-GEIGY CORPORATION (US) 1981-12-15 US claimed
US-4281204-A ALKYLATION, DECARBOXYLATION TO CYCLIZE FRITZSCHE DODGE & OLCOTT INC. (US) 1981-07-28 US claimed
US-4249000-A SEMIPERMEABLE MEMBRANES FOR REVERSE OSMOSIS CIBA-GEIGY CORPORATION (US) 1981-02-03 US claimed