Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL259060

N.N.NCC1(NC2(CN)CCCCC2)CCCCC1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
BLM P54132 1/20 0.33
CACNA2D1 P54289 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLC6A3 Q01959 3/20 0.30
SLC6A4 P31645 2/20 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
SCHEMBL259109 0.97 USP2 (0.34) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL4351529 0.76 USP2 (0.32) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL8280715 0.76 USP2 (0.32) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL25532376 0.76 USP2 (0.32) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL11427488 0.72
SCHEMBL10975389 0.72
SCHEMBL23029153 0.72 USP2 (0.30) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL24230004 0.72 USP2 (0.30) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL21235180 0.72 USP2 (0.30) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL5827753 0.72 LMNA (0.31) USP2ALDH1A1LMNACYP1A2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8134028-B2 Method for producing 1,2-diamino-3-methylcyclohexane and/or 1,2-diamino-4-methylcyclohexane BASF SE (DE) 2012-03-13 US disclosed
US-20090253938-A1 Method for Producing 1,2-Diamino-3-Methylcyclohexane and/or 1,2-Diamino-4-Methylcyclohexane BASF AKTIENGESELLSCHAFT (DE) 2009-10-08 US disclosed
EP-1828097-B1 METHOD FOR PRODUCING 1,2-DIAMINO-3-METHYLCYCLOHEXANE AND/OR 1,2-DIAMINO-4-METHYLCYCLOHEXANE BASF SE (DE) 2008-05-07 EP disclosed
EP-1828097-A1 METHOD FOR PRODUCING 1,2-DIAMINO-3-METHYLCYCLOHEXANE AND/OR 1,2-DIAMINO-4-METHYLCYCLOHEXANE BASF AKTIENGESELLSCHAFT (DE) 2007-09-05 EP disclosed
WO-2006066762-A1 METHOD FOR PRODUCING 1,2-DIAMINO-3-METHYLCYCLOHEXANE AND/OR 1,2-DIAMINO-4-METHYLCYCLOHEXANE BASF AKTIENGESELLSCHAFT (DE) 2006-06-29 WO disclosed