SCHEMBL9468809

SCHEMBL9468809

[CH2]c1cnn(-c2ccccc2)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.55
KDM4E B2RXH2 6/20 0.48
HPGD P15428 3/20 0.48
HSD17B10 Q99714 2/20 0.46
LSS P48449 1/20 0.40
ALDH1A1 P00352 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
TSHR P16473 1/20 0.38
ELOVL1 Q9BW60 1/20 0.38
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
MAPT P10636 2/20 0.37
STAT1 P42224 1/20 0.37
GAA P10253 1/20 0.36
HDAC1 Q13547 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HTT P42858 1/20 0.36
ADORA2A P29274 2/20 0.35
ADORA1 P30542 2/20 0.35

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
SCHEMBL1037429 0.76 P2RX7 (0.53) P2RX7KDM4EHPGDHSD17B10LSS
SCHEMBL458507 0.76 P2RX7 (0.53) P2RX7KDM4EHPGDHSD17B10LSS
SCHEMBL11605633 0.76 P2RX7 (0.58) P2RX7KDM4EHPGDHSD17B10LSS
SCHEMBL18039129 0.76 P2RX7 (0.53) P2RX7KDM4EHPGDHSD17B10LSS
SCHEMBL17279823 0.74 KDM4E (0.56) P2RX7KDM4EHPGDHSD17B10LSS
SCHEMBL10689031 0.72 KDM4E (0.50) P2RX7KDM4EHPGDHSD17B10LSS
SCHEMBL1514733 0.71 P2RX7 (0.68) P2RX7KDM4EHPGDHSD17B10LSS
SCHEMBL16797793 0.71 P2RX7 (0.49) P2RX7KDM4EHPGDHSD17B10LSS
SCHEMBL6399282 0.71 P2RX7 (0.68) P2RX7KDM4EHPGDHSD17B10LSS
SCHEMBL4503007 0.71 P2RX7 (0.49) P2RX7KDM4EHPGDHSD17B10LSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5219857-A Method of treating cognitive and related neural behavioral problems AMERICAN CYANAMID COMPANY (US) 1993-06-15 US claimed
US-5126340-A Antidepressants AMERICAN CYANAMID COMPANY (US) 1992-06-30 US claimed
US-4562189-A HYPOTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1985-12-31 US claimed
US-5219857-A Method of treating cognitive and related neural behavioral problems AMERICAN CYANAMID COMPANY (US) 1993-06-15 US disclosed
US-5219857-A Method of treating cognitive and related neural behavioral problems AMERICAN CYANAMID COMPANY (US) 1993-06-15 US disclosed
US-5126340-A Antidepressants AMERICAN CYANAMID COMPANY (US) 1992-06-30 US disclosed
US-5126340-A Antidepressants AMERICAN CYANAMID COMPANY (US) 1992-06-30 US disclosed
US-4963553-A TREATING COGNITIVE AND NEURAL BEHAVIORAL PROBLEMS IN MAMMALS AMERICAN CYANAMID CO. (US) 1990-10-16 US disclosed
US-4562189-A HYPOTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1985-12-31 US disclosed