SCHEMBL764194

SCHEMBL764194

O=C(O)C1Cc2c([nH]c3ccccc23)C(c2ccccc2)N1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 1.00
TSHR P16473 1/20 1.00
MAPK1 P28482 1/20 1.00
KDM4E B2RXH2 4/20 0.71
MEN1 O00255 4/20 0.71
KMT2A Q03164 4/20 0.71
ALDH1A1 P00352 3/20 0.71
CYP2C19 P33261 1/20 0.71
SMN1; SMN2 Q16637 1/20 0.71
ALOX15 P16050 1/20 0.69
HSD17B10 Q99714 1/20 0.69
ALOX12 P18054 1/20 0.69
MAPT P10636 1/20 0.67
HPGD P15428 1/20 0.67
CCKBR P32239 2/20 0.63
HDAC1 Q13547 2/20 0.61
HDAC6 Q9UBN7 2/20 0.61
PDE5A O76074 1/20 0.56
KIF11 P52732 2/20 0.55

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
SCHEMBL4787100 1.00 CYP2D6 (1.00) CYP2D6TSHRMAPK1KDM4EMEN1
SCHEMBL28478851 1.00 CYP2D6 (1.00) CYP2D6TSHRMAPK1KDM4EMEN1
SCHEMBL29630317 1.00 CYP2D6 (1.00) CYP2D6TSHRMAPK1KDM4EMEN1
SCHEMBL3481444 1.00 CYP2D6 (1.00) CYP2D6TSHRMAPK1KDM4EMEN1
SCHEMBL17760630 1.00 CYP2D6 (1.00) CYP2D6TSHRMAPK1KDM4EMEN1
SCHEMBL2215687 0.92 CYP2D6 (0.85) CYP2D6TSHRMAPK1KDM4EMEN1
SCHEMBL17760541 0.91 CYP2D6 (0.83) CYP2D6TSHRMAPK1KDM4EMEN1
SCHEMBL32689432 0.91 CYP2D6 (0.83) CYP2D6TSHRMAPK1KDM4EMEN1
SCHEMBL32689431 0.91 CYP2D6 (0.83) CYP2D6TSHRMAPK1KDM4EMEN1
SCHEMBL17760584 0.91 CYP2D6 (0.83) CYP2D6TSHRMAPK1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891187-B1 USE OF DERIVATIVES OF TETRAHYDRO-BETA-CARBOLINES AS ANTIMETASTATIC AGENTS HOFFMANN LA ROCHE (CH) 2002-01-30 EP claimed
US-6069150-A METALLOPROTRINASE INHIBITOR F. HOFFMAN-LA ROCHE AG (CH) 2000-05-30 US claimed
US-20240043422-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC. (US) 2024-02-08 US disclosed
CN-116059203-A Autotaxin inhibitors and uses thereof 赛博治疗有限责任公司 2023-05-05 CN disclosed
US-11613538-B2 Method of inhibiting or reducing a viral infection PTC THERAPEUTICS, INC. (US) 2023-03-28 US disclosed
CN-111303148-B 1-substituted beta-carboline derivatives and application thereof 南京农业大学 2022-08-30 CN disclosed
EP-2434891-B9 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS INC (US) 2021-05-05 EP disclosed
US-20200317668-A1 METHOD OF INHIBITING OR REDUCING A CORONAVIRIDAE VIRUS INFECTION PTC THERAPEUTICS, INC. 2020-10-08 US disclosed
EP-3718405-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC Therapeutics, Inc. (US) 2020-10-07 EP disclosed
EP-2434891-B1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS INC (US) 2020-07-22 EP disclosed
CN-111303148-A 1-substituted β -carboline derivatives and application thereof 南京农业大学 2020-06-19 CN disclosed
US-20070281962-A2 Administering 1,2,3,6-tetrasubstituted pyrido[3,4-b]indoles to inhibit the 5'-untranslated region-dependent translation; anticarcinogenic agents; retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, macular degeneration PCT THERAPEUTICS, INC. (US) 2007-12-06 US disclosed
US-20070254878-A1 ADMINISTRATION OF CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES PTC THERAPEUTICS, INC. 2007-11-01 US disclosed
US-20070254878-A1 ADMINISTRATION OF CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES PTC THERAPEUTICS, INC. 2007-11-01 US disclosed
WO-2005089764-A9 CARBOLINE DERIVATIVES USEFUL IN THE INHIBITION OF ANGIOGENESIS PTC THERAPEUTICS INC (US) 2007-09-13 WO disclosed
EP-1634881-A1 HARMINE DERIVATIVES, INTERMEDIATES USED IN THEIR PREPARATION, PREPARATION PROCESSES AND USE THEREOF Xinjiang Huashidan Pharmaceutical Research Co., Ltd. (CN) 2006-03-15 EP disclosed
WO-2004113336-A1 CARBOLINE AND BETACARBOLINE DERIVATIVES FOR USE AS HDAC ENZYME INHIBITORS CHROMA THERAPEUTICS LIMITED (GB) 2004-12-29 WO disclosed
EP-0891187-B1 USE OF DERIVATIVES OF TETRAHYDRO-BETA-CARBOLINES AS ANTIMETASTATIC AGENTS HOFFMANN LA ROCHE (CH) 2002-01-30 EP disclosed
US-6069150-A METALLOPROTRINASE INHIBITOR F. HOFFMAN-LA ROCHE AG (CH) 2000-05-30 US disclosed
US-4336260-A Method and compositions using 1-aryl-1,2,3,4-tetrahydro-β-carboline-3-carboxylic acid for treating depression THE DOW CHEMICAL COMPANY (US) 1982-06-22 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 (5 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-20240043422-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA CYP2D6 4809/4885TSHR 4486/4885MAPK1 3087/4885
US-20070254878-A1 ADMINISTRATION OF CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISEASES VEGFA, FLT4, FLT1 CYP2D6 4041/4885TSHR 3369/4885MAPK1 3648/4885
US-20200317668-A1 METHOD OF INHIBITING OR REDUCING A CORONAVIRIDAE VIRUS INFECTION SARS1, POLRMT, EIF2AK2 CYP2D6 3664/4885TSHR 4635/4885MAPK1 2584/4885
US-11613538-B2 Method of inhibiting or reducing a viral infection SARS1, EIF2AK2, POLRMT CYP2D6 4147/4885TSHR 4754/4885MAPK1 2450/4885
US-20070281962-A2 Administering 1,2,3,6-tetrasubstituted pyrido[3,4-b]indoles to inhibit the 5'-untranslated region-dependent translation; anticarcinogenic agents; retinopathy, rheumatoid arthritis, psoriasis, atherosclerosis, obesity, macular degeneration VEGFA, FLT4, MIF CYP2D6 2555/4885TSHR 2025/4885MAPK1 2092/4885

“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.