SCHEMBL235264

SCHEMBL235264

[CH2]C(C)CC(C)CCCC

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.36
OPRM1 P35372 1/20 0.35
ACE2 Q9BYF1 1/20 0.34
ALDH1A1 P00352 3/20 0.32
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 2/20 0.32
TSHR P16473 4/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP3A4 P08684 1/20 0.31
FDPS P14324 1/20 0.31
CA2 P00918 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL3885089 0.95 DNM1 (0.33) DNM1OPRM1ACE2ALDH1A1TDP1
SCHEMBL1971842 0.92 OPRM1 (0.44) DNM1OPRM1ACE2LMNATSHR
SCHEMBL5084014 0.90 ACE2 (0.45) DNM1OPRM1ACE2LMNATSHR
SCHEMBL5085923 0.90 ACE2 (0.45) DNM1OPRM1ACE2LMNATSHR
SCHEMBL10937533 0.90 ACE2 (0.45) DNM1OPRM1ACE2LMNATSHR
SCHEMBL3366905 0.90 ACE2 (0.45) DNM1OPRM1ACE2LMNATSHR
SCHEMBL2761289 0.90 ACE2 (0.45) DNM1OPRM1ACE2LMNATSHR
SCHEMBL5085904 0.90 ACE2 (0.45) DNM1OPRM1ACE2LMNATSHR
SCHEMBL11096927 0.90 ACE2 (0.45) DNM1OPRM1ACE2LMNATSHR
SCHEMBL1969416 0.90 ACE2 (0.45) DNM1OPRM1ACE2LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117986215-A 2-Phenyl-4-acyl benzofurans, preparation and application thereof 中国医学科学院药物研究所 2024-05-07 CN claimed
CN-116693479-A BysspinA derivative, preparation method and pharmaceutical application thereof 中国医学科学院药物研究所 2023-09-05 CN claimed
CN-117986215-A 2-Phenyl-4-acyl benzofurans, preparation and application thereof 中国医学科学院药物研究所 2024-05-07 CN disclosed
CN-111372916-B Process for producing dipyrrolidine compounds 巴斯夫欧洲公司 2024-03-26 CN disclosed
WO-2023182221-A1 METHOD FOR PRODUCING QUANTUM DOTS 日本化学工業株式会社 2023-09-28 WO disclosed
CN-116693479-A BysspinA derivative, preparation method and pharmaceutical application thereof 中国医学科学院药物研究所 2023-09-05 CN disclosed
CN-112480938-B Negative dielectric anisotropy liquid crystal composition and liquid crystal display device 烟台显华化工科技有限公司 2022-09-27 CN disclosed
US-11345680-B2 Method for producing bispyrrolidine compounds BASF SE (DE) 2022-05-31 US disclosed
CN-112480938-A Negative dielectric anisotropy liquid crystal composition and liquid crystal display device 烟台显华化工科技有限公司 2021-03-12 CN disclosed
US-20200392115-A1 METHOD FOR PRODUCING BISPYRROLIDINE COMPOUNDS BASF SE (DE) 2020-12-17 US disclosed
EP-3713915-A1 METHOD FOR PRODUCING BISPYRROLIDINE COMPOUNDS BASF SE (DE) 2020-09-30 EP disclosed
EP-0693284-A1 PROSTACYCLIN-CONTAINING OLEAGINOUS OINTMENT TEIJIN LIMITED (JP) 1996-01-24 EP disclosed
US-4317818-A 3,17-DIOXOANDROST-4-EN-19-AL AND DERIVATIVES RICHARDSON-MERRELL INC. (US) 1982-03-02 US disclosed
US-4096254-A STEROIDS RICHARDSON-MERRELL INC. (US) 1978-06-20 US disclosed
US-4088760-A TREATMENT OF ACNE AND OILY SKIN RICHARDSON-MERRELL INC. (US) 1978-05-09 US disclosed
US-4078060-A ANDROSTENONES RICHARDSON-MERRELL INC. (US) 1978-03-07 US disclosed
US-4078061-A ANDROSTENONES RICHARDSON-MERRELL INC. (US) 1978-03-07 US disclosed
US-4055641-A STEROID, 3-OXO-ANDROST-4-ENES RICHARDSON-MERRELL INC. (US) 1977-10-25 US disclosed
US-4054651-A Method of contraception RICHARDSON-MERRELL INC. (US) 1977-10-18 US disclosed
US-4013762-A STEROIDS WITHOUT ANDROGENIZING EFFECT RICHARDSON-MERRELL INC. (US) 1977-03-22 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-20200392115-A1 METHOD FOR PRODUCING BISPYRROLIDINE COMPOUNDS BBOX1, DHPS, BCKDK DNM1 2909/4885OPRM1 1005/4885ACE2 1793/4885
US-11345680-B2 Method for producing bispyrrolidine compounds BCKDK, BBOX1, DHPS DNM1 2924/4885OPRM1 875/4885ACE2 1263/4885

“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.