SCHEMBL542776

SCHEMBL542776

C1CC[C](C2CCCCCC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.36
NISCH Q9Y2I1 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
DAO P14920 1/20 0.30
CYP11B2 P19099 1/20 0.30
DPP7 Q9UHL4 1/20 0.30
TRIM24 O15164 1/20 0.30
TRIM33 Q9UPN9 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
SCHEMBL7737845 1.00 KMT2A (0.36) KMT2ANISCHCA1CA2CA4
SCHEMBL61818 1.00 KMT2A (0.36) KMT2ANISCHCA1CA2CA4
SCHEMBL77969 1.00 KMT2A (0.36) KMT2ANISCHCA1CA2CA4
SCHEMBL13858690 1.00 KMT2A (0.36) KMT2ANISCHCA1CA2CA4
SCHEMBL9956415 1.00 KMT2A (0.36) KMT2ANISCHCA1CA2CA4
SCHEMBL25327994 1.00 KMT2A (0.36) KMT2ANISCHCA1CA2CA4
SCHEMBL7340365 1.00 KMT2A (0.36) KMT2ANISCHCA1CA2CA4
SCHEMBL11594630 1.00 KMT2A (0.36) KMT2ANISCHCA1CA2CA4
SCHEMBL625943 1.00 KMT2A (0.36) KMT2ANISCHCA1CA2CA4
SCHEMBL61394 1.00 KMT2A (0.36) KMT2ANISCHCA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070179122-A1 Beta-Aminoacid-Derivatives As Factor Xa Inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-08-02 US claimed
EP-1723164-A1 BETA-AMINOACID-DERIVATIVES AS FACTOR Xa INHIBITORS Sanofi-Aventis Deutschland GmbH (DE) 2006-11-22 EP claimed
WO-2005095440-A1 BETA-AMINOACID-DERIVATIVES AS FACTOR Xa INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-10-13 WO claimed
EP-1571154-A1 Beta-aminoacid-derivatives as factor Xa inhibitors Aventis Pharma Deutschland GmbH (DE) 2005-09-07 EP claimed
EP-0944587-B1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARM (GB) 2002-03-20 EP claimed
US-6291452-B1 CHOLECYSTOKININ ANTAGONISTS. FUJISAWA PHARMACETICAL CO., LTD. (JP) 2001-09-18 US claimed
EP-0560163-A1 Imidazolylmethyl substituted phenylacetic-acid amides, process for their preparation and their pharmaceutical application BAYER AG (DE) 1993-09-15 EP claimed
EP-0560162-A1 Imidazolylmethyl substituted phenylacetic-acid amides, process for their preparation and their pharmaceutical application BAYER AG (DE) 1993-09-15 EP claimed
CN-116829560-A Oxytocin receptor modulators 金奥克斯治疗有限公司 2023-09-29 CN disclosed
CN-114621207-A Compound as thyroid hormone beta receptor agonist and application thereof 广东东阳光药业有限公司 2022-06-14 CN disclosed
CN-113717122-A Adamantane spirofluorene derivative and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2021-11-30 CN disclosed
EP-3442982-B1 CATALYST FOR THE HYDROFORMYLATION OF OLEFINS, AND USE THEREOF UNIV BERLIN TECH (DE) 2020-07-01 EP disclosed
EP-3442982-A1 CATALYST FOR THE HYDROFORMYLATION OF OLEFINS, AND USE THEREOF Technische Universität Berlin (DE) 2019-02-20 EP disclosed
WO-2017178536-A1 CATALYST FOR THE HYDROFORMYLATION OF OLEFINS, AND USE THEREOF Technische Universität Berlin (DE) 2017-10-19 WO disclosed
EP-0560163-A1 Imidazolylmethyl substituted phenylacetic-acid amides, process for their preparation and their pharmaceutical application BAYER AG (DE) 1993-09-15 EP disclosed
EP-0560162-A1 Imidazolylmethyl substituted phenylacetic-acid amides, process for their preparation and their pharmaceutical application BAYER AG (DE) 1993-09-15 EP disclosed
WO-1993016063-A1 CYCLOHEXENONE OXIME ETHERS, PROCESS FOR MAKING THEM AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1993-08-19 WO disclosed
EP-0491509-A1 One part heat curable organopolysiloxane compositions GENERAL ELECTRIC COMPANY (US) 1992-06-24 EP disclosed
US-4994299-A Epoxyhaloarylaklsiloxane with polyaryloniumhexafluorometalloid salt photoinitiator GENERAL ELECTRIC COMPANY (US) 1991-02-19 US disclosed
EP-0404029-A1 Substantially odor free, UV curable organopolysiloxane release coating compositions and coating method GENERAL ELECTRIC COMPANY (US) 1990-12-27 EP 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 (1 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-20070179122-A1 Beta-Aminoacid-Derivatives As Factor Xa Inhibitors F12, F11, F5 KMT2A 1442/4885NISCH 3897/4885CA1 1495/4885

“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.