SCHEMBL11782884

SCHEMBL11782884

Cc1nc(N)c(C(=O)Cl)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 3/20 0.35
HSD17B10 Q99714 1/20 0.35
GABRP O00591 1/20 0.34
GABRD O14764 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34
GABRB2 P47870 1/20 0.34
GABRA4 P48169 1/20 0.34
GABRE P78334 1/20 0.34
GABRA6 Q16445 1/20 0.34
GABRG1 Q8N1C3 1/20 0.34
GABRG3 Q99928 1/20 0.34
GABRQ Q9UN88 1/20 0.34

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
SCHEMBL28149480 0.85 GABRP (0.46) SLC9A1SMN1; SMN2KDM4EGABRPGABRD
Hydrochloric Acid SCHEMBL11548592 0.84 GABRP (0.44) SLC9A1SMN1; SMN2KDM4EGABRPGABRD
SCHEMBL559000 0.73 CD44 (0.37) SLC9A1SMN1; SMN2KDM4ELMNAALDH1A1
SCHEMBL8478664 0.71 CD44 (0.46) SMN1; SMN2KDM4ELMNAKMT2AALDH1A1
SCHEMBL15537755 0.71 CD44 (0.41) SMN1; SMN2KDM4ELMNAALDH1A1
SCHEMBL23779668 0.69 ALDH1A1 (0.48) SMN1; SMN2KDM4EKMT2AALDH1A1POLB
SCHEMBL10564551 0.69 KEAP1 (0.53) SMN1; SMN2KDM4EHSD17B10GABRPGABRD
SCHEMBL31255799 0.69 CD44 (0.56) SLC9A1KDM4ELMNAKMT2AGAA
SCHEMBL15537882 0.68 LMNA (0.41) SMN1; SMN2KDM4ELMNAKMT2AALDH1A1
SCHEMBL16501095 0.68 KHK (0.44) SMN1; SMN2KDM4ELMNAALDH1A1

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-3950160-A INHIBITING THE GROWTH OF WEEDS WITH 2-SUBSTITUTED PYRDIDOPYIMIDINES AND SALTS THEREOF PFIZER INC. (US) 1976-04-13 US disclosed