SCHEMBL8337754

SCHEMBL8337754

Cc1ccc(OCCN2CCCC2)cc1

nearest known ligand 0.82

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.70
LTA4H P09960 8/20 0.68
KDM4E B2RXH2 1/20 0.68
PSMB1 P20618 5/20 0.67
PSMB5 P28074 5/20 0.67
PSMB2 P49721 3/20 0.67
MAPK14 Q16539 1/20 0.63
PTGS2 P35354 3/20 0.63
PTGS1 P23219 1/20 0.63
ALDH1A1 P00352 1/20 0.62

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
SCHEMBL82435 0.98 HRH3 (0.73) HRH3LTA4HKDM4EPSMB1PSMB5
SCHEMBL12035585 0.98 HRH3 (0.73) HRH3LTA4HKDM4EPSMB1PSMB5
Hydrochloric Acid SCHEMBL8972891 0.98 HRH3 (0.68) HRH3LTA4HKDM4EPSMB1PSMB5
Hydrochloric Acid SCHEMBL6473996 0.96 HRH3 (0.71) HRH3LTA4HKDM4EPSMB1PSMB5
SCHEMBL15834053 0.96 HRH3 (0.66) HRH3LTA4HKDM4EPSMB1PSMB5
SCHEMBL7447133 0.95 HRH3 (0.73) HRH3LTA4HKDM4EPSMB1PSMB5
SCHEMBL2629440 0.91 HRH3 (0.72) HRH3KDM4EMAPK14
SCHEMBL7135133 0.91 LTA4H (0.73) HRH3LTA4HPSMB1PSMB5PSMB2
SCHEMBL10200146 0.89 HRH3 (0.75) HRH3KDM4EMAPK14
SCHEMBL2827364 0.89 HRH3 (0.75) HRH3KDM4EMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023192502-A1 SPIROBICYCLIC COMPOUNDS ACERAND THERAPEUTICS (USA) LIMITED (US) 2023-10-05 WO disclosed
EP-4219465-A2 PRMT5 INHIBITORS AND USES THEREOF Epizyme Inc (US) 2023-08-02 EP disclosed
EP-3498701-B1 PRMT5 INHIBITORS AND USES THEREOF EPIZYME INC (US) 2023-02-22 EP disclosed
US-11576891-B2 Methods of treating or preventing estrogen-related diseases ENDORECHERCHE, INC. 2023-02-14 US disclosed
WO-2021156636-A1 TRIAZOLE DERIVATIVES WITH ANTIFUNGAL ACTIVITY KING'S COLLEGE LONDON (GB) 2021-08-12 WO disclosed
EP-2414328-B1 DIHYDROOROTATE DEHYDROGENASE INHIBITORS MERCK SERONO SA (CH) 2021-05-26 EP disclosed
EP-3517536-B1 AMINOTRIAZINE DERIVATIVES USEFUL AS TANK-BINDING KINASE INHIBITOR COMPOUNDS GILEAD SCIENCES INC (US) 2021-05-05 EP disclosed
EP-2947084-B1 FIVE-AND-SIX-MEMBERED HETEROCYCLIC COMPOUND, AND PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF GUANGZHOU MAXINOVEL PHARMACEUTICALS CO (CN) 2020-09-23 EP disclosed
US-20200054643-A1 FUSED HETEROCYCLIC COMPOUNDS AS SELECTIVE BMP INHIBITORS VANDERBILT UNIVERSITY 2020-02-20 US disclosed
US-10478443-B2 Sex steroid precursors alone or in combination with selective estrogen receptor modulators for the prevention and treatment of sexual dysfunction in postmenopausal women ENDORECHERCHE, INC. (CA) 2019-11-19 US disclosed
US-20070191447-A1 Novel heterocyclic compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-08-16 US disclosed
US-20070161677-A1 Bisarylurea derivatives MERCK PATENT GMBH (DE) 2007-07-12 US disclosed
US-20070161677-A1 Bisarylurea derivatives MERCK PATENT GMBH (DE) 2007-07-12 US disclosed
US-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations TARGEGEN, INC. (US) 2007-06-28 US disclosed
WO-2007056075-A2 SIX MEMBERED HETEROAROMATIC INHIBITORS TARGETING RESISTANT KINASE MUTATIONS TARGEGEN, INC. (US) 2007-05-18 WO disclosed
WO-2004000842-A1 SUBSTITUTED 2,4-DIHYDRO-PYRROLO (3, 4-B) -QUINOLIN-9-ONE DERIVATIVES USEFUL AS PHOSPHODIESTERASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2003-12-31 WO disclosed
WO-2003020721-A1 PYRROLO PYRIMIDINES AS AGENTS FOR THE INHIBITION OF CYSTEIN PROTEASES NOVARTIS AG (CH) 2003-03-13 WO disclosed
EP-0702962-A2 Preparations for inhibiting mammalian breast carcinoma with tamoxifen and analogs thereof, and certain naphthyl compounds ELI LILLY AND COMPANY (US) 1996-03-27 EP disclosed
EP-0703228-A1 Naphthyl compounds, intermediates, processes, compositions involving them ELI LILLY AND COMPANY (US) 1996-03-27 EP disclosed
EP-0702961-A2 Compositions for minimizing the uterotrophic effect of tamoxifen and its analogs ELI LILLY AND COMPANY (US) 1996-03-27 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 (6 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-20070161677-A1 Bisarylurea derivatives BRAF, RAF1, NRAS HRH3 2940/4885LTA4H 4652/4885KDM4E 2459/4885
US-20200054643-A1 FUSED HETEROCYCLIC COMPOUNDS AS SELECTIVE BMP INHIBITORS BMP1, BMP4, BMPR2 HRH3 1002/4885LTA4H 3896/4885KDM4E 1511/4885
US-20070191447-A1 Novel heterocyclic compound OPRD1, GRIN3A, GRM3 HRH3 92/4885LTA4H 2031/4885KDM4E 2970/4885
US-11576891-B2 Methods of treating or preventing estrogen-related diseases SHBG, ESRRA, ESR2 HRH3 1922/4885LTA4H 1161/4885KDM4E 2595/4885
US-10478443-B2 Sex steroid precursors alone or in combination with selective estrogen receptor modulators for the prevention and treatment of sexual dysfunction in postmenopausal women GPER1, ESR1, ESR2 HRH3 857/4885LTA4H 817/4885KDM4E 622/4885
US-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations ABL1, KDR, BCR HRH3 1949/4885LTA4H 4439/4885KDM4E 523/4885

“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.