SCHEMBL7417993

SCHEMBL7417993

NCC1CC2CCN1CC2

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.38
CHRNB2 P17787 3/20 0.38
CHRNA4 P43681 3/20 0.38
GAA P10253 1/20 0.38
ALPG P10696 1/20 0.38
GFER P55789 1/20 0.38
CHRNA7 P36544 1/20 0.38
NCF1 P14598 1/20 0.32
NOS3 P29474 1/20 0.30
NOS1 P29475 1/20 0.30
NOS2 P35228 1/20 0.30

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
SCHEMBL22444327 0.85
SCHEMBL11296604 0.74 CHRNB2 (0.38) CHRNB2CHRNA4GAAALPGGFER
SCHEMBL10956440 0.74 CHRNB2 (0.38) CHRNB2CHRNA4GAAALPGGFER
SCHEMBL2422039 0.74 GAA (0.42) CHRNB2CHRNA4GAAALPGGFER
SCHEMBL10965978 0.74 CHRNB2 (0.38) CHRNB2CHRNA4GAAALPGGFER
Hydrochloric Acid SCHEMBL29396072 0.72 GAA (0.41) CHRNB2CHRNA4GAAALPGGFER
SCHEMBL1950582 0.72 CHRNB2 (0.37) CHRNB2CHRNA4GAAALPGGFER
Hydrochloric Acid SCHEMBL29936885 0.72 GAA (0.44) CHRNB2CHRNA4GAAALPGGFER
SCHEMBL6533484 0.72 CHRNB2 (0.34) CHRNB2CHRNA4GAAALPGGFER
SCHEMBL31151644 0.70 CHRNB2 (0.36) CHRNB2CHRNA4GAAALPGGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023104209-A1 METTL3 INHIBITOR COMPOUND 上海昂阔医药有限公司 2023-06-15 WO disclosed
US-5521155-A Amides of teicoplanin compounds GRUPPO LEPETIT S.P.A (IT) 1996-05-28 US disclosed
EP-0370283-B1 Process for preparing 63-carboxyamides of teicoplanin antibiotics LEPETIT SPA (IT) 1994-06-15 EP disclosed
US-5198418-A Substituted alkylamides of teicoplanin compounds GRUPPO LEPETIT S.P.A. (IT) 1993-03-30 US disclosed
EP-0340245-B1 SUBSTITUTED ALKYLAMIDES OF TEICOPLANIN COMPOUNDS GRUPPO LEPETIT S.p.A. (IT) 1992-08-19 EP disclosed
EP-0218099-B1 AMIDES OF TEICOPLANIN COMPOUNDS GRUPPO LEPETIT S.p.A. (IT) 1991-12-11 EP disclosed
EP-0370283-A2 Process for preparing 63-carboxyamides of teicoplanin antibiotics GRUPPO LEPETIT S.p.A. (IT) 1990-05-30 EP disclosed
EP-0340245-A1 SUBSTITUTED ALKYLAMIDES OF TEICOPLANIN COMPOUNDS. LEPETIT SPA (IT) 1989-11-08 EP disclosed
WO-1988006600-A1 SUBSTITUTED ALKYLAMIDES OF TEICOPLANIN COMPOUNDS GRUPPO LEPETIT S.P.A. (IT) 1988-09-07 WO disclosed
EP-0218099-A2 Amides of teicoplanin compounds GRUPPO LEPETIT S.p.A. (IT) 1987-04-15 EP disclosed
US-4089960-A Antiemetic, psychosomatic and antipsychotic heterocyclic pyridine carboxamides CIBA-GEIGY CORPORATION (US) 1978-05-16 US disclosed