SCHEMBL2736710

SCHEMBL2736710

CC(C)[C@H](O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.65
LMNA P02545 3/20 0.65
ADRA2C P18825 2/20 0.65
ADRA2A P08913 1/20 0.65
HIF1A Q16665 1/20 0.65
ALDH1A1 P00352 3/20 0.62
CHRM2 P08172 1/20 0.60
ADRA1A P35348 1/20 0.60
RGS12 O14924 1/20 0.60
GLA P06280 1/20 0.60
CYP3A4 P08684 1/20 0.60
CYP2D6 P10635 1/20 0.60
CYP2C9 P11712 1/20 0.60
PKM P14618 1/20 0.60
ALOX15 P16050 1/20 0.60
TSHR P16473 1/20 0.60
ALOX12 P18054 1/20 0.60
NFKB1 P19838 1/20 0.60
HTR2A P28223 1/20 0.60
CYP2C19 P33261 1/20 0.60

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
SCHEMBL765762 1.00 KDM4E (0.65) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL1961679 1.00 KDM4E (0.65) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL9504694 0.97 KDM4E (0.62) KDM4ELMNAADRA2CADRA2AHIF1A
Hydrochloric Acid SCHEMBL29430219 0.97 ALDH1A1 (0.67) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL9504702 0.97 KDM4E (0.62) KDM4ELMNAADRA2CADRA2AHIF1A
Alcohol SCHEMBL9255166 0.91 KDM4E (0.57) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL19757666 0.85 CYP3A4 (0.58) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL17878528 0.85 CYP3A4 (0.58) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL6839350 0.85 KDM4E (0.46) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL21473258 0.84 KDM4E (0.60) KDM4ELMNAADRA2CADRA2AHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295115-A1 SUBSTITUTED ISOQUINOLINYLMETHYL AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORP (CA) 2023-09-21 US disclosed
US-11725010-B2 Polyheterocyclic compounds as METTL3 inhibitors STORM THERAPEUTICS LIMITED (GB) 2023-08-15 US disclosed
US-20230192671-A1 COMPOUNDS FOR THE TREATMENT OF SARS PURDUE RESEARCH FOUNDATION 2023-06-22 US disclosed
US-20230192671-A1 COMPOUNDS FOR THE TREATMENT OF SARS PURDUE RESEARCH FOUNDATION 2023-06-22 US disclosed
WO-2023104209-A1 METTL3 INHIBITOR COMPOUND 上海昂阔医药有限公司 2023-06-15 WO disclosed
US-20230142606-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC AMINO COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-05-11 US disclosed
US-20230131903-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-04-27 US disclosed
US-20220185789-A1 PESTICIDALLY ACTIVE DIAZINE-AMIDE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2022-06-16 US disclosed
US-20220119329-A1 Manganese Catalysts and Their Use in Hydrogenation of Ketones UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) 2022-04-21 US disclosed
EP-3956330-A1 SUBSTITUTED 2-AMINO-PYRAZOLYL-[1,2,4]TRIAZOLO[1,5A] PYRIDINE DERIVATIVES AND USE THEREOF The Johns Hopkins University (US) 2022-02-23 EP disclosed
EP-0817770-B1 NONPEPTIDES AS TACHYKININ ANTAGONISTS WARNER LAMBERT CO (US) 2002-02-27 EP disclosed
EP-0564924-B1 2-Oxoethyl derivatives as immunosuppressants BAYER AG (US) 1998-09-09 EP disclosed
EP-0817770-A1 NONPEPTIDES AS TACHYKININ ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1998-01-14 EP disclosed
US-5686424-A FOR TREATING INFLAMMATION MILES INC. (US) 1997-11-11 US disclosed
WO-1996029304-A1 NONPEPTIDES AS TACHYKININ ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1996-09-26 WO disclosed
US-5554641-A Nonpeptides as tachykinin antagonists WARNER-LAMBERT COMPANY 1996-09-10 US disclosed
EP-0608002-A1 Optically active compounds UNIVERSITY OF STRATHCLYDE (GB) 1994-07-27 EP disclosed
EP-0564924-A2 2-Oxoethyl derivatives as immunosuppressants Bayer Corporation (US) 1993-10-13 EP disclosed
US-4959472-A Process for preparing substantially pure diastereoisomers of tetrahydrofolic derivatives UNIVERSITY OF STRATHCLYDE (GB) 1990-09-25 US disclosed
EP-0266042-A2 Optically active pteridine derivatives University of Strathclyde (GB) 1988-05-04 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 (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-20230131903-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS DDT, ACHE, GSTO1 KDM4E 3772/4885LMNA 2308/4885ADRA2C 345/4885
US-20230142606-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC AMINO COMPOUNDS DDT, ACHE, DDC KDM4E 3102/4885LMNA 3307/4885ADRA2C 413/4885
US-20230295115-A1 SUBSTITUTED ISOQUINOLINYLMETHYL AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME HCCS, HAVCR2, HDGF KDM4E 692/4885LMNA 2574/4885ADRA2C 4466/4885
US-20220185789-A1 PESTICIDALLY ACTIVE DIAZINE-AMIDE COMPOUNDS DDT, ACHE, NIT2 KDM4E 2663/4885LMNA 2904/4885ADRA2C 1346/4885
US-20230192671-A1 COMPOUNDS FOR THE TREATMENT OF SARS ACE2, ACE, SARS1 KDM4E 3407/4885LMNA 2592/4885ADRA2C 1164/4885
US-11725010-B2 Polyheterocyclic compounds as METTL3 inhibitors METTL3, DIMT1, TPMT KDM4E 107/4885LMNA 2764/4885ADRA2C 4323/4885
US-20220119329-A1 Manganese Catalysts and Their Use in Hydrogenation of Ketones CYC1, SCO2, MT-CO3 KDM4E 2900/4885LMNA 319/4885ADRA2C 3053/4885

“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.