SCHEMBL26348195

SCHEMBL26348195

C1=CCN(Cc2ccccc2)C(Oc2ccccc2)N(Cc2ccccc2)C1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.40
CYP2C19 P33261 1/20 0.39
GBA1 P04062 1/20 0.39
HRH3 Q9Y5N1 2/20 0.38
MAPT P10636 1/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
SPHK2 Q9NRA0 2/20 0.36
SPHK1 Q9NYA1 2/20 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
SCHEMBL504801 0.70 MAPT (0.49) SIGMAR1MAPTALDH1A1
SCHEMBL9603295 0.68 FUCA1 (0.53) SIGMAR1HRH3GAASMN1; SMN2
SCHEMBL21812117 0.68 SIGMAR1 (0.42) SIGMAR1HRH3GAASMN1; SMN2
SCHEMBL21812115 0.68 SIGMAR1 (0.42) SIGMAR1HRH3GAASMN1; SMN2
SCHEMBL1639608 0.66 SIGMAR1 (0.65) SIGMAR1ALDH1A1
SCHEMBL4855546 0.66 HRH3 (0.74) SIGMAR1HRH3GAASMN1; SMN2
SCHEMBL11990561 0.63 SIGMAR1 (0.48) SIGMAR1GAAALDH1A1KMT2A
SCHEMBL10607825 0.63 HRH3 (0.62) CYP2C19HRH3GAASMN1; SMN2
SCHEMBL9682997 0.63 FAAH (0.57) GBA1SPHK2SPHK1
SCHEMBL5743634 0.63 MAPT (0.58) SIGMAR1GBA1MAPTALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230303776-A1 FULLY AND PARTIALLY BACKBONE-DEGRADABLE POLYMERS VIA LOW TEMPERATURE RING-OPENING METATHESIS POLYMERIZATION (ROMP) NORTHWESTERN UNIVERSITY (US) 2023-09-28 US disclosed