SCHEMBL9635952

SCHEMBL9635952

ClCc1nc2cccnc2n1Cc1cnccn1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.45
ENPP2 Q13822 8/20 0.43
TBXA2R P21731 1/20 0.42
TP53 P04637 4/20 0.40
TLR7 Q9NYK1 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
GABRA1 P14867 1/20 0.38
GABRA5 P31644 1/20 0.38
KCNK13 Q9HB14 1/20 0.38
MAPT P10636 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL9634927 0.80 CHRM5 (0.50) LMNATLR7MEN1KMT2A
SCHEMBL4988044 0.73 LMNA (0.43) LMNAENPP2TBXA2RTP53MEN1
SCHEMBL4772386 0.73 TP53 (0.51) LMNAENPP2TBXA2RTP53MEN1
SCHEMBL9635804 0.73 LMNA (0.47) LMNAENPP2TBXA2RTP53MEN1
SCHEMBL9540969 0.72 LMNA (0.46) LMNAENPP2TBXA2RTP53MEN1
SCHEMBL6881772 0.72 DRD4 (0.48) LMNATP53MAPT
SCHEMBL29643806 0.71 MTNR1A (0.44) GABRA1GABRA5KCNK13
SCHEMBL29491420 0.68 LMNA (0.40) LMNAENPP2TBXA2RTP53MEN1
SCHEMBL29111000 0.68 LMNA (0.40) LMNAENPP2TBXA2RTP53MEN1
SCHEMBL9634894 0.68 SLC6A9 (0.53) LMNAENPP2TBXA2RTP53MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5086056-A Treating allergic diseases JANSSEN PHARMACEUTICA N.V. (BE) 1992-02-04 US disclosed
US-5011842-A Antihistamines JANSSEN PHARMACEUTICA N.V. (BE) 1991-04-30 US disclosed
US-4946843-A ANTIALLERGENS JANSSEN PHARMACEUTICA N.V. (BE) 1990-08-07 US disclosed