SCHEMBL9437538

SCHEMBL9437538

O=C1CN(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)c2cs[c]n2)CCN1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ F2 P00734 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ GFER P55789 1/20 0.35
▸ REN P00797 1/20 0.34
▸ MMP2 P08253 4/20 0.34
▸ MMP9 P14780 3/20 0.34
▸ ADAMTS4 O75173 1/20 0.34
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ ALOX5AP P20292 1/20 0.33
▸ FEN1 P39748 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL9437535 0.89 REN (0.41) ALDH1A1MEN1KMT2ASMN1; SMN2REN
SCHEMBL9437573 0.84 ALDH1A1 (0.39) ALDH1A1MEN1KMT2ASMN1; SMN2REN
SCHEMBL9437597 0.84 MEN1 (0.49) ALDH1A1MEN1KMT2ASMN1; SMN2REN
SCHEMBL9437614 0.84 F2 (0.36) ALDH1A1MEN1KMT2AF2SMN1; SMN2
SCHEMBL9437653 0.81 ALDH1A1 (0.39) ALDH1A1MEN1KMT2ASMN1; SMN2REN
SCHEMBL9437637 0.81 ALDH1A1 (0.40) ALDH1A1MEN1KMT2ARENLMNA
SCHEMBL9437602 0.80 F2 (0.36) ALDH1A1MEN1KMT2AF2SMN1; SMN2
SCHEMBL9437553 0.80 F2 (0.36) ALDH1A1MEN1KMT2AF2SMN1; SMN2
SCHEMBL7338835 0.73 REN (0.46) REN
SCHEMBL9437652 0.73 REN (0.40) ALDH1A1RENMMP2TSHR

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-5332742-A Ocular hypotensive ABBOTT LABORATORIES (US) 1994-07-26 — — US disclosed
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