SCHEMBL20804428

SCHEMBL20804428

C[C@@H]([SiH3])c1ccc(C(C)(C)C)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.52
▸ LMNA P02545 2/20 0.44
▸ TYR P14679 1/20 0.44
▸ GRIA4 P48058 4/20 0.43
▸ NR1H4 Q96RI1 2/20 0.41
▸ TP53 P04637 1/20 0.39
▸ KIF11 P52732 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ GPR35 Q9HC97 1/20 0.38
▸ PDE2A O00408 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ AKR1C3 P42330 1/20 0.37
▸ AKR1C2 P52895 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35

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
SCHEMBL28534136 1.00 TSHR (0.52) TSHRLMNATYRGRIA4NR1H4
SCHEMBL9621026 0.79 TSHR (0.50) TSHRLMNATYRGRIA4NR1H4
SCHEMBL548066 0.79 TSHR (0.50) TSHRLMNATYRGRIA4NR1H4
SCHEMBL28479739 0.78 PDE2A (0.50) TSHRKIF11PDE2AALDH1A1AKR1C3
SCHEMBL292572 0.76 TSHR (0.52) TSHRLMNATYRGRIA4NR1H4
SCHEMBL24209319 0.75 PDE2A (0.63) TSHRLMNATYRGRIA4NR1H4
SCHEMBL18282984 0.75 LMNA (0.50) TSHRLMNATYRGRIA4NR1H4
SCHEMBL2644008 0.75 LMNA (0.50) TSHRLMNATYRGRIA4NR1H4
SCHEMBL17722885 0.75 TSHR (0.46) TSHRLMNATYRGRIA4NR1H4
SCHEMBL12241427 0.75 TSHR (0.46) TSHRLMNATYRGRIA4NR1H4

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
EP-2255250-B1 POSITIVE RESIST COMPOSITION FUJIFILM CORP (JP) 2019-03-13 — — EP disclosed
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