SCHEMBL4463749

SCHEMBL4463749

CCCCC(CC)COC(=O)C1C=C2OC2CC1C(=O)OCC(CC)CCCC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
CYP3A4 P08684 4/20 0.43
CA2 P00918 2/20 0.43
TSHR P16473 3/20 0.42
TDP1 Q9NUW8 3/20 0.42
ATM Q13315 1/20 0.42
LMNA P02545 3/20 0.40
MAPK1 P28482 3/20 0.40
HSD17B10 Q99714 1/20 0.40
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
RECQL P46063 1/20 0.37
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
MMP14 P50281 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CTDSP1 Q9GZU7 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
SCHEMBL28396693 0.93 ALDH1A1 (0.42) ALDH1A1CYP3A4CA2TSHRTDP1
SCHEMBL11878353 0.91 POLB (0.32)
SCHEMBL4460395 0.82 CHRM2 (0.35) ALDH1A1CYP3A4TSHRTDP1ATM
SCHEMBL5831942 0.80 PPARG (0.39) ALDH1A1CYP3A4TSHRLMNAMAPK1
SCHEMBL27991858 0.80 PPARG (0.39) ALDH1A1CYP3A4TSHRLMNAMAPK1
Ethane SCHEMBL11881538 0.80 CHRM2 (0.36) ALDH1A1CYP3A4TSHRLMNAMAPK1
SCHEMBL4469290 0.79 CA1 (0.36) ALDH1A1CA2TSHRHSD17B10L3MBTL1
SCHEMBL1297731 0.78 CYP3A4 (0.60) ALDH1A1CYP3A4CA2TSHRTDP1
SCHEMBL818820 0.77 CYP3A4 (0.47) ALDH1A1CYP3A4CA2TSHRTDP1
SCHEMBL28228526 0.77 CHRM2 (0.37) ALDH1A1TSHRLMNAHSD17B10L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113717505-B Degradable plastic and preparation method thereof 上海乐亿塑料制品有限公司 2023-04-07 CN claimed
US-4292462-A INSULATORS-COOLANTS FOR TRANSFORMERS RHONE-POULENC INDUSTRIES (FR) 1981-09-29 US claimed
US-4119555-A COOLANTS FOR TRANSFORMERS RHONE-POULENC INDUSTRIES (FR) 1978-10-10 US claimed
CN-113116847-B Gastric retention tablet 广州玻思韬控释药业有限公司 2024-03-29 CN disclosed
CN-113116850-B Gastric retention tablet 广州玻思韬控释药业有限公司 2024-03-19 CN disclosed
CN-113116846-B Gastric retention tablet 广州玻思韬控释药业有限公司 2024-03-19 CN disclosed
CN-113116845-B Gastric retention tablet 广州玻思韬控释药业有限公司 2024-03-19 CN disclosed
CN-113116839-B Gastric retention tablet 广州玻思韬控释药业有限公司 2024-02-06 CN disclosed
CN-113717505-B Degradable plastic and preparation method thereof 上海乐亿塑料制品有限公司 2023-04-07 CN disclosed
CN-113116845-A Stomach retention tablet 广州玻思韬控释药业有限公司 2021-07-16 CN disclosed
CN-113116839-A Stomach retention tablet 广州玻思韬控释药业有限公司 2021-07-16 CN disclosed
EP-0119821-B1 OIL-IMPREGNATED CAPACITOR MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1990-05-23 EP disclosed
US-4535382-A Oil-impregnated capacitor MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1985-08-13 US disclosed
EP-0119821-A2 Oil-impregnated capacitor MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1984-09-26 EP disclosed
US-4292462-A INSULATORS-COOLANTS FOR TRANSFORMERS RHONE-POULENC INDUSTRIES (FR) 1981-09-29 US disclosed
US-4177156-A SPECIALTY OILS FOR TRANSFORMERS RHONE-POULENC INDUSTRIES (FR) 1979-12-04 US disclosed
US-4142983-A PHTHALATE MIXTURES USEFUL AS LIQUID DIELECTRICS RHONE-POULENC INDUSTRIES (FR) 1979-03-06 US disclosed
EP-0000042-A1 Process for the preparation of 2,4,5-trichloropyrimidine BAYER AG (DE) 1978-12-20 EP disclosed
US-4119555-A COOLANTS FOR TRANSFORMERS RHONE-POULENC INDUSTRIES (FR) 1978-10-10 US disclosed
US-3935731-A Method and means for improving flaw entrapment efficiency in water-washable inspection penetrants ALBURGER JAMES R 1976-02-03 US disclosed