SCHEMBL11749337

SCHEMBL11749337

O=CCCCSc1nnnn1-c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 10/20 0.61
▸ TSHR P16473 4/20 0.61
▸ LMNA P02545 4/20 0.61
▸ HPGD P15428 3/20 0.61
▸ SMN1; SMN2 Q16637 2/20 0.61
▸ POLB P06746 3/20 0.60
▸ NPSR1 Q6W5P4 1/20 0.60
▸ MAPT P10636 2/20 0.58
▸ MEN1 O00255 1/20 0.58
▸ KMT2A Q03164 1/20 0.58
▸ TP53 P04637 3/20 0.58
▸ L3MBTL1 Q9Y468 3/20 0.58
▸ NPC1 O15118 1/20 0.58
▸ NFKB1 P19838 1/20 0.58
▸ RAB9A P51151 1/20 0.58
▸ NFKB2 Q00653 1/20 0.58
▸ RELA Q04206 1/20 0.58
▸ TDP1 Q9NUW8 1/20 0.58
▸ THRB P10828 2/20 0.57
▸ HSD17B10 Q99714 1/20 0.56

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
SCHEMBL10970208 0.87 ALDH1A1 (0.71) ALDH1A1TSHRLMNAHPGDSMN1; SMN2
SCHEMBL10973042 0.87 ALDH1A1 (0.71) ALDH1A1TSHRLMNAHPGDSMN1; SMN2
SCHEMBL4414411 0.86 ALDH1A1 (0.61) ALDH1A1TSHRLMNAHPGDSMN1; SMN2
SCHEMBL8177830 0.82 ALDH1A1 (0.77) ALDH1A1TSHRLMNAHPGDSMN1; SMN2
SCHEMBL7303919 0.81 ALDH1A1 (0.66) ALDH1A1TSHRLMNAHPGDSMN1; SMN2
SCHEMBL10972734 0.81 ALDH1A1 (0.63) ALDH1A1TSHRLMNAHPGDSMN1; SMN2
SCHEMBL16116944 0.81 ALDH1A1 (0.72) ALDH1A1TSHRLMNAHPGDSMN1; SMN2
SCHEMBL7301329 0.81 ALDH1A1 (0.66) ALDH1A1TSHRLMNAHPGDSMN1; SMN2
SCHEMBL10678708 0.81 ALDH1A1 (0.70) ALDH1A1TSHRLMNAHPGDSMN1; SMN2
SCHEMBL16526226 0.80 ALDH1A1 (0.70) ALDH1A1TSHRLMNAHPGDSMN1; SMN2

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-4009029-A PHOTOGRAPHY EASTMAN KODAK COMPANY (US) 1977-02-22 — — US disclosed
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