SCHEMBL2396745

SCHEMBL2396745

NC(=S)Nc1cc[nH]n1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL4785366 0.84 ALDH1A1 (0.32)
SCHEMBL3070460 0.81
SCHEMBL3065903 0.79
SCHEMBL3077441 0.79
SCHEMBL402279 0.79
SCHEMBL4526969 0.79
Hydrochloric Acid SCHEMBL28556945 0.78 KLK1 (0.30)
Hydrochloric Acid SCHEMBL29794674 0.78 CYP1A2 (0.37)
SCHEMBL3064600 0.72
SCHEMBL11323653 0.72 IDO1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4214197-A1 SUBSTITUTED PYRIDINE DERIVATIVES AS SARM1 INHIBITORS Nura Bio, Inc. (US) 2023-07-26 EP disclosed
CN-109970760-B ACC inhibitors and uses thereof 吉利德阿波罗公司 2022-04-26 CN disclosed
WO-2022060812-A1 SUBSTITUTED PYRIDINE DERIVATIVES AS SARM1 INHIBITORS NURA BIO, INC. (US) 2022-03-24 WO disclosed
CN-109096194-B Biguanide derivative, pharmaceutical composition, preparation method and application 湖南师范大学 2022-02-08 CN disclosed
CN-109320508-B Compound with isothiazolinone and N-arylpyrazole structure and preparation method and application thereof 南京工业大学 2020-07-17 CN disclosed
CN-109096194-A A kind of Biguanide derivative, pharmaceutical composition, preparation method and purposes 湖南师范大学 2018-12-28 CN disclosed
EP-1888546-B1 THIAZOLE DERIVATIVES AND USE THEREOF MERCK SERONO SA (CH) 2015-07-08 EP disclosed
CN-103113304-A Pyrazole thiourea derivative as well as preparation method and application thereof UNIV ANHUI AGRICULTURAL 2013-05-22 CN disclosed
CN-103113304-A Pyrazole thiourea derivative as well as preparation method and application thereof UNIV ANHUI AGRICULTURAL 2013-05-22 CN disclosed
CN-103113304-A Pyrazole thiourea derivative as well as preparation method and application thereof UNIV ANHUI AGRICULTURAL 2013-05-22 CN disclosed
EP-1353674-A1 METHOD FOR TREATING GLAUCOMA IVB Alteon, Inc. (US) 2003-10-22 EP disclosed
US-6596745-B2 Fibrosis therapy ALTEON, INC. 2003-07-22 US disclosed
US-20030004194-A1 Method for treating fibrotic diseases or other indications VI ALTEON, INC. (US) 2003-01-02 US disclosed
US-20030004195-A1 Method for treating glaucoma VI ALTEON, INC. (US) 2003-01-02 US disclosed
WO-2002096362-A2 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS VI ALTEON INC. (US) 2002-12-05 WO disclosed
WO-2002096317-A2 METHOD FOR TREATING GLAUCOMA VI ALTEON, INC. (US) 2002-12-05 WO disclosed
US-20020156073-A1 Method for treating glaucoma IVB ALTEON, INC. 2002-10-24 US disclosed
US-20020107245-A1 Method for treating fibrotic diseases or other indications IVC ALTEON, INC. 2002-08-08 US disclosed
WO-2002053101-A2 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS ALTEON, INC. (US) 2002-07-11 WO disclosed
WO-2002053160-A1 METHOD FOR TREATING GLAUCOMA IVB ALTEON, INC. (US) 2002-07-11 WO disclosed