SCHEMBL11599488

SCHEMBL11599488

COC(=O)Nc1[c]cc[c]c1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.37
HPGD P15428 3/20 0.35
MAPT P10636 1/20 0.33
LMNA P02545 2/20 0.30
ALDH1A1 P00352 1/20 0.30
ALOX15 P16050 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL5158336 0.80 SMN1; SMN2 (0.34) SMN1; SMN2HPGDMAPTLMNAALDH1A1
SCHEMBL6598611 0.76 PEPD (0.33) MAPTALDH1A1
SCHEMBL7067134 0.76 CA12 (0.38) SMN1; SMN2HPGDMAPTLMNAALDH1A1
SCHEMBL11410354 0.76 CA1 (0.38) SMN1; SMN2HPGDMAPTLMNAALDH1A1
SCHEMBL11404951 0.76 L3MBTL1 (0.44) SMN1; SMN2HPGDMAPTLMNAALDH1A1
SCHEMBL1415961 0.73 SMN1; SMN2 (0.43) SMN1; SMN2HPGDMAPTLMNAALDH1A1
SCHEMBL7068047 0.73 TP53 (0.43) SMN1; SMN2HPGDMAPTLMNAALDH1A1
SCHEMBL11694848 0.72 SMN1; SMN2 (0.38) SMN1; SMN2HPGDMAPTLMNAALDH1A1
SCHEMBL11410301 0.70 ALDH1A1 (0.43) SMN1; SMN2HPGDALDH1A1
SCHEMBL11601668 0.70

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-RE29834-E PREPARED FROM 4-SULFONYL-1,8-NAPHTHOLACTAMS BAYER AKTIENGESELLSCHAFT (DE) 1978-11-14 US claimed