SCHEMBL881834

SCHEMBL881834

FC(F)(F)c1cc(N=C=S)ccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HTR3E A5X5Y0 1/20 0.56
▸ HTR3B O95264 1/20 0.56
▸ HTR3A P46098 1/20 0.56
▸ HTR3D Q70Z44 1/20 0.56
▸ HTR3C Q8WXA8 1/20 0.56
▸ IDO1 P14902 2/20 0.40
▸ KDR P35968 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ NOTUM Q6P988 7/20 0.40
▸ MAPK1 P28482 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ NPFFR2 Q9Y5X5 3/20 0.39
▸ NPFFR1 Q9GZQ6 2/20 0.39
▸ P2RY6 Q15077 1/20 0.37
▸ PYCR1 P32322 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MIF P14174 1/20 0.36

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
SCHEMBL11287987 0.86 HTR3E (0.40) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL23270232 0.84 HTR3E (0.44) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL23270208 0.84 AR (0.47) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL58303 0.82 MAPK1 (0.61) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL29397209 0.82 MAPK1 (0.61) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL15563090 0.81 CA1 (0.45) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL23270216 0.81 HTR3E (0.44) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL30543083 0.81 CA1 (0.45) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL30543087 0.81 CA1 (0.45) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL1435515 0.80 P2RY6 (0.38) HTR3EHTR3BHTR3AHTR3DHTR3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160250175-A1 COMBINED APPLICATION OF ISOTHIOCYANATE COMPOUND AND ANTI-CANCER MEDICINE JC (WUXI) COMPANY, INC. (CN) 2016-09-01 — — US claimed
EP-3034076-A1 COMBINED APPLICATION OF ISOTHIOCYANATE COMPOUND AND ANTI-CANCER MEDICINE JC (Wuxi) COMPANY, Inc. (CN) 2016-06-22 — — EP claimed
CN-103992265-B Two three bromo 1,3-bis-pyridine alkali propane and preparation method thereof, using method, recovery method and application XI'AN JIAOTONG UNIVERSITY (CN) 2016-02-24 — — CN claimed
CN-103992265-A Double tribromo 1,3-bipyridine onium salt dimethylmethane, and preparation method, application method, recovery method and application thereof UNIV XI AN JIAOTONG 2014-08-20 — — CN claimed
US-20250216398-A1 IDENTIFICATION OF AMINO ACIDS OR SHORT PEPTIDES LUXEMBOURG INSTITUTE OF SCIENCE AND TECHNOLOGY (LIST) (LU) 2025-07-03 — — US disclosed
US-20250197443-A1 METHOD AND DEVICE FOR CLEAVING AND/OR SEQUENCING A PEPTIDE LUXEMBOURG INSTITUTE OF SCIENCE AND TECHNOLOGY (LIST) (LU) 2025-06-19 — — US disclosed
EP-4493934-A1 METHOD AND DEVICE FOR CLEAVING AND/OR SEQUENCING A PEPTIDE LUXEMBOURG INSTITUTE OF SCIENCE AND TECHNOLOGY (LIST) (LU) 2025-01-22 — — EP disclosed
EP-3446689-B1 ISOTHIOCYANATE COMPOUND FOR USE IN THE TREATMENT OF HYPERBILIRUBINEMIA JC WUXI COMPANY INC (CN) 2025-01-08 — — EP disclosed
CN-113262218-B Use of isothiocyanate compounds 无锡杰西医药股份有限公司 2024-06-18 — — CN disclosed
WO-2023174860-A1 IDENTIFICATION OF AMINO ACIDS OR SHORT PEPTIDES LUXEMBOURG INSTITUTE OF SCIENCE AND TECHNOLOGY (LIST) (LU) 2023-09-21 — — WO disclosed
WO-2023174823-A1 METHOD AND DEVICE FOR CLEAVING AND/OR SEQUENCING A PEPTIDE LUXEMBOURG INSTITUTE OF SCIENCE AND TECHNOLOGY (LIST) (LU) 2023-09-21 — — WO disclosed
US-20230265075-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. 2023-08-24 — — US disclosed
US-5814646-A TREATING THE PROGRESSION OF ALZHEIMER'S DISEASE, BRAIN DISORDERS ELI LILLY AND COMPANY (US) 1998-09-29 — — US disclosed
US-5760066-A AIDS, ATHEROSCLEROSIS, CANCER SUGEN, INC. (US) 1998-06-02 — — US disclosed
US-5624937-A TREATMENT OF ALZHEIMER'S DISEASE ELI LILLY AND COMPANY (US) 1997-04-29 — — US disclosed
WO-1996033179-A1 THIOAMIDES DERIVATES AND THEIR USE AS INHIBITORS OF HYPER-PROLIFERATIVE CELL GROWTH SUGEN, INC. (US) 1996-10-24 — — WO disclosed
US-5399565-A Treatment of psychological, central nervous system and gastrointestinal disorders ELI LILLY AND COMPANY (US) 1995-03-21 — — US disclosed
US-5300514-A Pyrazolidinone CCK and gastrin antagonists and pharmaceutical formulations thereof ELI LILLY AND COMPANY (US) 1994-04-05 — — US disclosed
US-4913722-A HERBICIDES ICI AMERICAS INC. (US) 1990-04-03 — — US disclosed
EP-0318253-A1 Iminophenylthiazolidines, process of preparation, and method of use ICI AMERICAS INC. (US) 1989-05-31 — — 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 (3 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-20160250175-A1 COMBINED APPLICATION OF ISOTHIOCYANATE COMPOUND AND ANTI-CANCER MEDICINE CHUK, KIT, MKI67 HTR3E 2361/4885HTR3B 2360/4885HTR3A 3106/4885
US-20250197443-A1 METHOD AND DEVICE FOR CLEAVING AND/OR SEQUENCING A PEPTIDE ANPEP, DNPEP, PTMS HTR3E 1555/4885HTR3B 1439/4885HTR3A 3191/4885
US-20230265075-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS JAK2, JAK3, STAT5B HTR3E 926/4885HTR3B 514/4885HTR3A 1337/4885

“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.

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