SCHEMBL10596825

SCHEMBL10596825

C[Si](C)(C)CCSCCNC(=O)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 7/20 0.63
▸ LMNA P02545 3/20 0.63
▸ RAB9A P51151 7/20 0.62
▸ NPC1 O15118 6/20 0.62
▸ RECQL P46063 1/20 0.62
▸ ALDH1A1 P00352 7/20 0.59
▸ HPGD P15428 3/20 0.59
▸ CYP1A2 P05177 1/20 0.58
▸ CYP3A4 P08684 1/20 0.58
▸ CYP2C9 P11712 1/20 0.58
▸ CYP2C19 P33261 1/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ POLB P06746 1/20 0.53
▸ NFKB1 P19838 2/20 0.51
▸ NFKB2 Q00653 2/20 0.51
▸ RELA Q04206 2/20 0.51
▸ CASP3 P42574 1/20 0.51
▸ SENP8 Q96LD8 1/20 0.51
▸ SENP7 Q9BQF6 1/20 0.51
▸ SENP6 Q9GZR1 1/20 0.51

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
SCHEMBL10594665 0.85 NPC1 (0.56) SMN1; SMN2RAB9ANPC1ALDH1A1HPGD
SCHEMBL10595233 0.84 RAB9A (0.66) SMN1; SMN2RAB9ANPC1ALDH1A1CYP1A2
SCHEMBL9324910 0.82 SMN1; SMN2 (0.69) SMN1; SMN2LMNARAB9ANPC1RECQL
SCHEMBL18878471 0.81 SMN1; SMN2 (0.67) SMN1; SMN2LMNARAB9ANPC1RECQL
SCHEMBL14029065 0.81 SMN1; SMN2 (0.67) SMN1; SMN2LMNARAB9ANPC1RECQL
SCHEMBL22373763 0.80 NAAA (0.65) SMN1; SMN2LMNARAB9ANPC1ALDH1A1
SCHEMBL4347123 0.78 RAB9A (0.68) SMN1; SMN2LMNARAB9ANPC1RECQL
SCHEMBL10484573 0.78 SMN1; SMN2 (0.71) SMN1; SMN2LMNARAB9ANPC1RECQL
SCHEMBL10595285 0.78 NPC1 (0.64) SMN1; SMN2LMNARAB9ANPC1ALDH1A1
SCHEMBL15023510 0.78 LMNA (1.00) SMN1; SMN2LMNARAB9ANPC1RECQL

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4560679-A Organosilicon compounds and antitumor agents containing the compound as effective component SANWA KAGAKU KENKYUSHO CO. LTD. (JP) 1985-12-24 — — US claimed
EP-0109195-A2 Antitumor organosilicon compounds and their preparation SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1984-05-23 — — EP claimed
JP-59070692-A — — None — — JP disclosed
EP-0109195-B1 ANTITUMOR ORGANOSILICON COMPOUNDS AND THEIR PREPARATION SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1989-01-11 — — EP disclosed
US-4560679-A Organosilicon compounds and antitumor agents containing the compound as effective component SANWA KAGAKU KENKYUSHO CO. LTD. (JP) 1985-12-24 — — US disclosed
EP-0109195-A2 Antitumor organosilicon compounds and their preparation SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1984-05-23 — — EP disclosed
JP-S5970692-A NOVEL ORGANIC SILICON COMPOUND, ITS NON-TOXIC SALT, ITS PREPARATION AND ANTITUMOR AGENT CONTAINING SAID COMPOUND AS ACTIVE COMPONENT SANWA KAGAKU KENKYUSHO:KK 1984-04-21 — — JP disclosed
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