SCHEMBL9255747

SCHEMBL9255747

CCn1nnc(-c2cnc3c(C)cccn3c2=O)n1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.40
MAPT P10636 3/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
LMNA P02545 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
TSHR P16473 4/20 0.38
ALDH1A1 P00352 4/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HPGD P15428 2/20 0.36
KDM4E B2RXH2 2/20 0.36
HSD17B10 Q99714 1/20 0.36
RECQL P46063 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HDAC8 Q9BY41 1/20 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
SCHEMBL9210655 0.91 TP53 (0.39) TP53MAPTLMNAALDH1A1HPGD
Hydrochloric Acid SCHEMBL9219227 0.90 TP53 (0.39) TP53MAPTLMNAALDH1A1HPGD
SCHEMBL9256673 0.87 TP53 (0.39) TP53MAPTLMNAALDH1A1MEN1
SCHEMBL9255403 0.86 MAPT (0.38) TP53MAPTLMNAALDH1A1HPGD
SCHEMBL9213292 0.86 MAPT (0.38) TP53MAPTLMNATSHRALDH1A1
SCHEMBL9215578 0.85 MAPT (0.37) TP53MAPTLMNAALDH1A1HPGD
SCHEMBL9207052 0.85 TP53 (0.38) TP53MAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL9255151 0.85 TP53 (0.40) TP53MAPTLMNASMN1; SMN2TSHR
SCHEMBL9259987 0.85 TP53 (0.50) TP53MAPTLMNAALDH1A1HPGD
SCHEMBL9260614 0.84 MAPT (0.40) TP53MAPTLMNAALDH1A1HPGD

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-5475000-A Antiulcer agents CHINOIN GYOGYSZER-ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1995-12-12 US disclosed
US-5384406-A Hydrolysis resistant; agriculture chemical anions ISP INVESTMENTS INC. (US) 1995-01-24 US disclosed
WO-1993004065-A1 NEW 3-(SUBSTITUTED TETRAZOLYL)-4-OXO-4H-PYRIDO-[1,2-a]PYRIMIDINES, SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME CHINOIN GYÓGYSZER- ÉS VEGYÉSZETI TERMÉKEK GYÁRA RT. (HU) 1993-03-04 WO disclosed