SCHEMBL5800

SCHEMBL5800

O=Cc1ccc(-c2ccc(F)cc2)cc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.58
DRD1 P21728 5/20 0.52
KIF11 P52732 1/20 0.52
KMT2A Q03164 3/20 0.47
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 2/20 0.47
ALDH1A1 P00352 3/20 0.47
LMNA P02545 1/20 0.47
CYP2A6 P11509 2/20 0.46
HSD17B10 Q99714 1/20 0.46
ALDH5A1 P51649 1/20 0.46
ABAT P80404 1/20 0.46
BCL2L1 Q07817 1/20 0.44
BAD Q92934 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
DRD2 P14416 1/20 0.44
DRD4 P21917 1/20 0.44
DRD5 P21918 1/20 0.44
DRD3 P35462 1/20 0.44
POLB P06746 1/20 0.43

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
SCHEMBL2964 0.92
SCHEMBL10306547 0.92
Hydrochloric Acid SCHEMBL2831797 0.89 PTGS1 (0.52) PTGS1KMT2AKDM4EALDH1A1CYP2A6
SCHEMBL976904 0.86 CYP2A6 (0.58) DRD1KIF11KDM4EALDH1A1CYP2A6
SCHEMBL1666706 0.86 CYP2A6 (0.58) DRD1KIF11KDM4EALDH1A1CYP2A6
SCHEMBL25288128 0.86 CYP2A6 (0.58) DRD1KIF11KDM4EALDH1A1CYP2A6
SCHEMBL29043207 0.85 BCL2L1 (0.53) PTGS1KMT2AKDM4EMEN1ALDH1A1
SCHEMBL19285746 0.83 PTGS1 (0.44) PTGS1DRD1KIF11KMT2AKDM4E
SCHEMBL411725 0.83 KIF11 (0.52) PTGS1DRD1KIF11KMT2AKDM4E
Hydrochloric Acid SCHEMBL11476850 0.83 CYP2A6 (0.55) DRD1KIF11KDM4EALDH1A1CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113631548-B Serotonin 5-HT2B inhibiting compounds 硕腾服务有限责任公司 2023-06-06 CN claimed
JP-57064689-A None JP disclosed
EP-4655292-A1 NEW COMPOUNDS FOR TREATING STREPTOCOCCUS INFECTIONS Ab2 Therapeutics, S. L. (ES) 2025-12-03 EP disclosed
WO-2024226603-A1 THERAPEUTIC COMPOUNDS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2024-10-31 WO disclosed
CN-118666841-A Indole-tetramic acid compound, preparation and medical application thereof 中国医学科学院药物研究所 2024-09-20 CN disclosed
WO-2024156892-A1 NEW COMPOUNDS FOR TREATING STREPTOCOCCUS INFECTIONS ABAC Therapeutics, S.L. (ES) 2024-08-02 WO disclosed
EP-4406945-A1 NEW COMPOUNDS FOR TREATING STREPTOCOCCUS INFECTIONS ABAC THERAPEUTICS, S.L. (ES) 2024-07-31 EP disclosed
CN-116731006-B Thiazole aminoguanidine compound as well as preparation method and application thereof 广东省科学院微生物研究所(广东省微生物分析检测中心) 2024-04-02 CN disclosed
CN-116731006-A Thiazole aminoguanidine compound as well as preparation method and application thereof 广东省科学院微生物研究所(广东省微生物分析检测中心) 2023-09-12 CN disclosed
CN-116444457-B Phenyl thiazole compound, and preparation method and application thereof 广东省科学院微生物研究所(广东省微生物分析检测中心) 2023-08-15 CN disclosed
EP-0784612-A1 UREA DERIVATIVES AND THEIR USE AS ACAT-INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-07-23 EP disclosed
US-5612352-A INHIBITORS OF SQUALENE SYNTHASE AND ANTICHOLESTEROL AGENTS WITH BIPHENYLQUINUCLIDINE DERIVATIVES ZENECA LIMITED (GB) 1997-03-18 US disclosed
WO-1996010559-A1 UREA DERIVATIVES AND THEIR USE AS ACAT-INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-04-11 WO disclosed
US-5494606-A 1,3-dioxane derivatives, and liquid-crystalline medium MERCK PATENT GESELLSCAFT MIT BESCHRANKTER HAFTUNG (DE) 1996-02-27 US disclosed
EP-0596058-A1 BIPHENYLYLQUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LIMITED (GB) 1994-05-11 EP disclosed
WO-1993021184-A1 BIPHENYLYLQUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LIMITED (GB) 1993-10-28 WO disclosed
WO-1991016321-A1 1,3-DIOXANE DERIVATES AND LIQUID CRYSTAL MEDIUM MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1991-10-31 WO disclosed
US-4536515-A Substituted phenylalkenoic acids and esters MERCK FROSST CANADA, INC. (CA) 1985-08-20 US disclosed
US-4453005-A Process for preparing substituted phenylalkenoic acids MERCK FROSST CANADA, INC. (CA) 1984-06-05 US disclosed
JP-S5764689-A SUBSTITUTED BIPHENYLYLDIOXANE CHISSO CORP 1982-04-19 JP disclosed