SCHEMBL9745936

SCHEMBL9745936

CC(C)(C)[Sn](O)(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
CYP2C19 P33261 3/20 0.37
HIF1A Q16665 1/20 0.37
ALDH1A1 P00352 6/20 0.36
ALOX15 P16050 2/20 0.36
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
ESR1 P03372 2/20 0.34
ESR2 Q92731 2/20 0.34
CYP3A4 P08684 2/20 0.34

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
SCHEMBL9745344 0.79 ALDH1A1 (0.37) KMT2AMAPTCYP2C19HIF1AALDH1A1
SCHEMBL31352841 0.72 ALDH1A1 (0.37) KMT2AMAPTCYP2C19HIF1AALDH1A1
SCHEMBL31558571 0.72 MAPK1 (0.42) KMT2AMAPTCYP2C19HIF1AALDH1A1
SCHEMBL9745806 0.72 TRPA1 (0.33) HIF1AALDH1A1ALOX15ESR1ESR2
SCHEMBL9745740 0.72 ALDH1A1 (0.33) KMT2AMAPTCYP2C19HIF1AALDH1A1
Bromide SCHEMBL28375499 0.70 ESR1 (0.36) KMT2AMAPTALDH1A1ALOX15ESR1
SCHEMBL9745998 0.69 HPGD (0.33) KMT2ACYP2C19HIF1AALDH1A1TSHR
SCHEMBL9746366 0.69 TSHR (0.35) ALDH1A1ALOX15TSHRTDP1CES2
SCHEMBL9745777 0.69 TSHR (0.35) ALDH1A1ALOX15TSHRTDP1CES2
SCHEMBL9745422 0.68 MAPK1 (0.33) ALDH1A1ALOX15ESR1ESR2CYP3A4

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-5100762-A Radiation-sensitive polymer and radiation-sensitive composition containing the same MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1992-03-31 US disclosed