SCHEMBL9760461

SCHEMBL9760461

CCN(CC)CCNc1nc2cccnc2n1Cc1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 10/20 0.50
MAPT P10636 2/20 0.50
LMNA P02545 2/20 0.47
ENPP2 Q13822 7/20 0.46
RXFP1 Q9HBX9 1/20 0.45
POLB P06746 2/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
THRB P10828 1/20 0.43

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
SCHEMBL9761614 0.89 TP53 (0.49) TP53MAPTLMNAENPP2RXFP1
SCHEMBL17966808 0.81 TP53 (0.55) TP53MAPTLMNAENPP2RXFP1
Hydrochloric Acid SCHEMBL9760488 0.78 POLB (0.48) TP53MAPTLMNAENPP2POLB
SCHEMBL10446542 0.74 RAB9A (0.43) TP53LMNA
SCHEMBL17966778 0.72 TP53 (0.54) TP53MAPTLMNAENPP2RXFP1
SCHEMBL11480609 0.72 SSTR5 (0.57) TP53MAPTLMNAENPP2RXFP1
SCHEMBL11811773 0.71 TP53 (0.55) TP53MAPTLMNAENPP2RXFP1
SCHEMBL14263846 0.70 KCNH2 (0.62) TP53MAPTLMNA
SCHEMBL17966805 0.69 TP53 (0.59) TP53MAPTLMNAENPP2RXFP1
SCHEMBL17966877 0.69 TP53 (0.62) TP53MAPTLMNAENPP2RXFP1

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-5023256-A Antihistamines DOMPE FARMACEUTICI S.P.A. (IT) 1991-06-11 US disclosed