SCHEMBL9259178

SCHEMBL9259178

Cc1cccn2c(=O)c(-c3nnnn3Cc3ccc(Cl)c(Cl)c3)cnc12

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 10/20 0.42
MAPT P10636 2/20 0.41
FSCN1 Q16658 3/20 0.41
TDP1 Q9NUW8 1/20 0.40
LMNA P02545 1/20 0.39
TRPA1 O75762 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
TP53 P04637 2/20 0.37

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
SCHEMBL9273626 0.84 P2RX7 (0.43) P2RX7TDP1TRPA1SIGMAR1
SCHEMBL9260997 0.82 ESR1 (0.46) MAPTFSCN1TDP1LMNATP53
SCHEMBL9259561 0.81 MAPT (0.41) P2RX7MAPTLMNATP53
SCHEMBL9259671 0.79 ALDH1A1 (0.40) P2RX7MAPTLMNATP53
SCHEMBL9253888 0.78 MAPT (0.39) P2RX7MAPTLMNATP53
SCHEMBL9256075 0.77 MAPT (0.39) P2RX7MAPTLMNATP53
SCHEMBL9255925 0.77 MAPT (0.39) P2RX7MAPTLMNATP53
SCHEMBL9255701 0.76 MAPT (0.38) P2RX7MAPTLMNATP53
SCHEMBL356833 0.75 MAPT (0.41) MAPTLMNATP53
SCHEMBL18558870 0.74 TP53 (0.40) P2RX7MAPTLMNATP53

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-5475000-A Antiulcer agents CHINOIN GYOGYSZER-ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1995-12-12 US disclosed