SCHEMBL4499212

SCHEMBL4499212

O=S1(=O)CCC(CCO)CC1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ESR2 Q92731 2/20 0.35
BRD4 O60885 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.30
TYMP P19971 2/20 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
SCHEMBL5468894 0.86 ALDH1A1 (0.52) KDM4EALDH1A1SMN1; SMN2
SCHEMBL27302714 0.82 KDM4E (0.36) KDM4EALDH1A1
SCHEMBL1192172 0.79 ALDH1A1 (0.43) KDM4EALDH1A1ESR2SMN1; SMN2
SCHEMBL5475667 0.77 KDM4E (0.38) KDM4EALDH1A1
SCHEMBL6774136 0.77 KDM4E (0.38) KDM4EALDH1A1
SCHEMBL24456484 0.75 KDM4E (0.36) KDM4EALDH1A1
SCHEMBL178299 0.75 ALDH1A1 (0.36) KDM4EALDH1A1
SCHEMBL17162540 0.75 KDM4E (0.36) KDM4EALDH1A1
SCHEMBL16977515 0.75 KDM4E (0.36) KDM4EALDH1A1
SCHEMBL5733 0.74

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-122070282-A Pyrazole-1-carboxamides as RIP1 kinase inhibitors 比西切姆有限公司 2026-05-19 CN disclosed
WO-2025037940-A1 PYRAZOLE-1-CARBOXAMIDES AS RIP1 KINASE INHIBITORS BISICHEM CO., LTD. (KR) 2025-02-20 WO disclosed
US-11464790-B2 Triterpenoids with HIV maturation inhibitory activity ViiV Healthcare UK (No.4) Limited (GB) 2022-10-11 US disclosed
US-20210040062-A1 AZOLE-SUBSTITUTED PYRIDINE COMPOUND TAISHO PHARMACEUTICAL CO., LTD. (JP) 2021-02-11 US disclosed
US-20210040062-A1 AZOLE-SUBSTITUTED PYRIDINE COMPOUND TAISHO PHARMACEUTICAL CO., LTD. (JP) 2021-02-11 US disclosed
EP-3750910-A1 TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV Healthcare UK(No.4) Limited (GB) 2020-12-16 EP disclosed
EP-3750910-A1 TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV Healthcare UK(No.4) Limited (GB) 2020-12-16 EP disclosed
US-20200360404-A1 TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY BRISTOL-MYERS SQUIBB COMPANY 2020-11-19 US disclosed
US-20200360404-A1 TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY BRISTOL-MYERS SQUIBB COMPANY 2020-11-19 US disclosed
US-10780102-B2 Triterpenoids with HIV maturation inhibitory activity VIIV HEALTHCARE UK (NO. 4) LIMITED (GB) 2020-09-22 US disclosed
WO-2015157483-A1 TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY, SUBSTITUTED IN POSITION 3 BY A NON-AROMATIC RING CARRYING A HALOALKYL SUBSTITUENT BRISTOL-MYERS SQUIBB COMPANY (US) 2015-10-15 WO disclosed
WO-2015157483-A1 TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY, SUBSTITUTED IN POSITION 3 BY A NON-AROMATIC RING CARRYING A HALOALKYL SUBSTITUENT BRISTOL-MYERS SQUIBB COMPANY (US) 2015-10-15 WO disclosed
US-20150291655-A1 TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV HEALTHCARE UK (NO. 4) LIMITED (GB) 2015-10-15 US disclosed
US-20150291655-A1 TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV HEALTHCARE UK (NO. 4) LIMITED (GB) 2015-10-15 US disclosed
US-7781469-B2 Arylacetate derivatives having isoxazole skeleton SHIONOGI & CO., LTD. (JP) 2010-08-24 US disclosed
US-7501516-B2 Quinoline derivatives and their use as tyrosine kinase inhibitors ASTRAZENECA AB (SE) 2009-03-10 US disclosed
US-20090062531-A1 Arylacetate Derivatives Having Isoxazole Skeleton SHIONOGI & CO., LTD. (JP) 2009-03-05 US disclosed
EP-1296973-B1 GUANIDINE DERIVATIVES OF QUINAZOLINE FOR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES ASTRAZENECA AB (SE) 2008-11-05 EP disclosed
EP-1887000-A1 ARYLACETATE DERIVATIVE HAVING ISOXAZOLE SKELETON Shionogi Co., Ltd. (JP) 2008-02-13 EP disclosed
US-20050009867-A1 Quinoline derivatives and their use as tyrosine kinase inhibitors ASTRAZENECA AB (SE) 2005-01-13 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 (7 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-10780102-B2 Triterpenoids with HIV maturation inhibitory activity CYP51A1, CYP8B1, LSS KDM4E 2728/4885ALDH1A1 2104/4885ESR2 3343/4885
US-11464790-B2 Triterpenoids with HIV maturation inhibitory activity CYP51A1, CYP8B1, LSS KDM4E 2728/4885ALDH1A1 2104/4885ESR2 3343/4885
US-20090062531-A1 Arylacetate Derivatives Having Isoxazole Skeleton CYP2A7, CYP4X1, HAX1 KDM4E 1460/4885ALDH1A1 877/4885ESR2 2658/4885
US-20210040062-A1 AZOLE-SUBSTITUTED PYRIDINE COMPOUND CYP2F1, CYP21A2, CYP11B1 KDM4E 134/4885ALDH1A1 254/4885ESR2 2824/4885
US-20050009867-A1 Quinoline derivatives and their use as tyrosine kinase inhibitors ABL1, FLT3, JAK2 KDM4E 1156/4885ALDH1A1 3215/4885ESR2 3199/4885
US-20200360404-A1 TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY CYP51A1, CYP8B1, LSS KDM4E 2728/4885ALDH1A1 2104/4885ESR2 3343/4885
US-20150291655-A1 TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY CYP51A1, CYP8B1, LSS KDM4E 2728/4885ALDH1A1 2104/4885ESR2 3343/4885

“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.