SCHEMBL9211604

SCHEMBL9211604

CC(C)[Si](c1cc2cc(C(O)c3ccccc3)ccc2[nH]1)(C(C)C)C(C)C

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.41
EGFR P00533 3/20 0.40
PIK3CA P42336 3/20 0.40
MLKL Q8NB16 3/20 0.40
CHEK2 O96017 2/20 0.38
UGT2B7 P16662 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
PTGS2 P35354 1/20 0.35
HPGD P15428 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
BRD4 O60885 2/20 0.33
CREBBP Q92793 1/20 0.33

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
SCHEMBL10102393 0.74 BRD4 (0.55) PRMT5EGFRPIK3CAMLKLCHEK2
SCHEMBL10102375 0.72 KDM4E (0.43) EGFRPIK3CASMN1; SMN2HPGDLMNA
SCHEMBL1568740 0.72 CYP19A1 (0.47) LMNA
SCHEMBL7325948 0.72 CA1 (0.41)
SCHEMBL1363970 0.70 DYRK3 (0.54) HPGD
Hydrochloric Acid SCHEMBL8635004 0.70 MLKL (0.47) PRMT5EGFRPIK3CAMLKLCHEK2
SCHEMBL8871162 0.69 SLC6A2 (0.55) EGFRPIK3CAMLKLPTGS2
SCHEMBL477559 0.67 UGT2B7 (0.61) UGT2B7TSHR
SCHEMBL30161628 0.67 UGT2B7 (0.61) UGT2B7TSHR
SCHEMBL477557 0.67 UGT2B7 (0.61) UGT2B7TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0674619-A1 TRYPTAMINE ANALOGUES AS 5-HT 1?-LIKE AGONISTS SMITHKLINE BEECHAM PLC (GB) 1995-10-04 EP disclosed
WO-1994014770-A1 TRYPTAMINE ANALOGUES AS 5-HT1-LIKE AGONISTS SMITHKLINE BEECHAM PLC (GB) 1994-07-07 WO disclosed