SCHEMBL12328968

SCHEMBL12328968

CC(N)Cc1cnc[nH]1

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
SCHEMBL3925179 1.00
Hydrochloric Acid SCHEMBL20295961 0.98 HRH3 (1.00)
Hydrochloric Acid SCHEMBL27914617 0.98 HRH3 (1.00)
Hydrochloric Acid SCHEMBL1369323 0.98 HRH3 (1.00)
Hydrochloric Acid SCHEMBL20295958 0.98 HRH3 (1.00)
SCHEMBL18682135 0.84 HRH3 (0.72)
SCHEMBL2736110 0.83
SCHEMBL12680071 0.81 CYP3A4 (0.69)
SCHEMBL12257052 0.80 HRH3 (0.67)
SCHEMBL23192818 0.79

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3929203-A1 DERIVATIVES OF AMPHOTERICIN B Sfunga Therapeutics, Inc. (US) 2021-12-29 EP disclosed
EP-3283171-B1 DERIVATIVES OF AMPHOTERICIN B SFUNGA THERAPEUTICS INC (US) 2021-05-26 EP disclosed
WO-2020228478-A1 ANTI-TUMOR DIAZOBICYCLIC APOPTOSIS PROTEIN INHIBITOR 南京华威医药科技集团有限公司 2020-11-19 WO disclosed
WO-2020154673-A1 BIS(DIAZIRINE) DERIVATIVES AS PHOTO-CROSSSLINKER FOR TREATING CORNEAL ECTATIC DISORDERS AVEDRO, INC. (US) 2020-07-30 WO disclosed
WO-2019170051-A1 DACOS TYPE NNRTIS AMINO ACID ESTER DERIVATIVE, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREOF 云南大学 2019-09-12 WO disclosed
WO-2016168568-A1 DERIVATIVES OF AMPHOTERICIN B Revolution Medicines, Inc. (US) 2016-10-20 WO disclosed
US-20160304548-A1 Derivatives of Amphotericin B ELION THERAPEUTICS, INC. 2016-10-20 US disclosed
EP-2365050-B1 DI-AMIDO GELLANT FOR USE IN CONSUMER PRODUCT COMPOSITIONS PROCTER & GAMBLE (US) 2016-08-10 EP disclosed
EP-2365051-A1 Fluid detergent compositions comprising a di-amido gellant, and process for making The Procter & Gamble Company (US) 2011-09-14 EP disclosed
EP-2365050-A1 Di-amido gelaant for use in consumer product compositions The Procter & Gamble Company (US) 2011-09-14 EP disclosed