SCHEMBL11536760

SCHEMBL11536760

c1ccc(-n2nnnc2-c2nnnn2-c2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.65
L3MBTL1 Q9Y468 4/20 0.65
LMNA P02545 3/20 0.61
HSD17B10 Q99714 1/20 0.61
HTT P42858 3/20 0.57
HPGD P15428 2/20 0.57
MAPT P10636 1/20 0.57
CCR6 P51684 1/20 0.57
CACNA1B Q00975 1/20 0.57
APBA1 Q02410 1/20 0.57
NPSR1 Q6W5P4 3/20 0.55
TSHR P16473 3/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
PTGS2 P35354 2/20 0.53
PKM P14618 2/20 0.53
CYP1A2 P05177 1/20 0.51
POLB P06746 1/20 0.51
CYP2C9 P11712 1/20 0.51

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
SCHEMBL890039 0.89 LMNA (0.77) ALDH1A1L3MBTL1LMNAHSD17B10HTT
Bromide SCHEMBL351809 0.87 LMNA (0.74) ALDH1A1L3MBTL1LMNAHSD17B10HTT
Hydrochloric Acid SCHEMBL7981337 0.87 LMNA (0.74) ALDH1A1L3MBTL1LMNAHSD17B10HTT
Bromide SCHEMBL28098177 0.87 LMNA (0.74) ALDH1A1L3MBTL1LMNAHSD17B10HTT
SCHEMBL11531369 0.84 ALDH1A1 (0.70) ALDH1A1L3MBTL1LMNAHSD17B10HTT
SCHEMBL15541266 0.84 ALDH1A1 (0.63) ALDH1A1L3MBTL1LMNAHSD17B10HTT
SCHEMBL2736476 0.82 LMNA (0.57) ALDH1A1L3MBTL1LMNAHSD17B10HTT
SCHEMBL9381965 0.81 ALDH1A1 (0.68) ALDH1A1L3MBTL1LMNAHSD17B10HTT
SCHEMBL9488239 0.81 ALDH1A1 (0.48) ALDH1A1L3MBTL1LMNAHSD17B10HTT
SCHEMBL18292654 0.80 GAA (0.64) ALDH1A1L3MBTL1LMNAHTTHPGD

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-4142029-A Bis-tetrazoles as chemical blowing agents for foaming thermoplastic resins CIBA-GEIGY CORPORATION (US) 1979-02-27 US disclosed