SCHEMBL25947808

SCHEMBL25947808

Cc1ccccc1C/C(N)=N/C(=N)N

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTBP2 P56545 1/20 0.44
TAAR1 Q96RJ0 1/20 0.41
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPK8 P45983 1/20 0.38
MAPT P10636 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SHBG P04278 1/20 0.36
NLRP3 Q96P20 1/20 0.35
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
CASP3 P42574 1/20 0.33
CASP7 P55210 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL102787 0.79 LMNA (0.61) CTBP2TAAR1LMNASMN1; SMN2MAPK8
SCHEMBL102788 0.79 LMNA (0.61) CTBP2TAAR1LMNASMN1; SMN2MAPK8
SCHEMBL19611620 0.79 LMNA (0.61) CTBP2TAAR1LMNASMN1; SMN2MAPK8
SCHEMBL5792021 0.79 TAAR1 (0.48) CTBP2TAAR1LMNASMN1; SMN2MAPK8
Hydrochloric Acid SCHEMBL216730 0.77 TAAR1 (0.47) CTBP2TAAR1LMNASMN1; SMN2MAPK8
SCHEMBL5341820 0.74 CTBP2 (0.42) CTBP2TAAR1LMNASMN1; SMN2MAPK8
SCHEMBL5341813 0.74 CTBP2 (0.42) CTBP2TAAR1LMNASMN1; SMN2MAPK8
SCHEMBL23712598 0.72 CTBP2 (0.47) CTBP2TAAR1SMN1; SMN2MAPK8MAPT
SCHEMBL6448276 0.72 TAAR1 (0.50) CTBP2TAAR1MAPK8MAPTMEN1
SCHEMBL158861 0.71 CTBP2 (0.55) CTBP2TAAR1MAPK8MAPTMEN1

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-11720020-B2 Resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-08-08 US disclosed