SCHEMBL14367889

SCHEMBL14367889

COCc1cnc(-c2ccccc2)o1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.51
CYP11B2 P19099 2/20 0.51
ALOX15 P16050 1/20 0.49
TSHR P16473 1/20 0.49
CASP1 P29466 1/20 0.49
HDAC1 Q13547 3/20 0.46
HDAC2 Q92769 3/20 0.46
HDAC3 O15379 2/20 0.45
HDAC4 P56524 2/20 0.45
HDAC7 Q8WUI4 2/20 0.45
HDAC10 Q969S8 2/20 0.45
HDAC11 Q96DB2 2/20 0.45
HDAC8 Q9BY41 2/20 0.45
HDAC6 Q9UBN7 2/20 0.45
HDAC9 Q9UKV0 2/20 0.45
HDAC5 Q9UQL6 2/20 0.45
GAA P10253 2/20 0.44
GFER P55789 1/20 0.44
MAPT P10636 1/20 0.43
RAB9A P51151 9/20 0.42

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
SCHEMBL12827256 0.80 CYP11B1 (0.55) CYP11B1CYP11B2ALOX15TSHRCASP1
SCHEMBL14382237 0.77 HDAC1 (0.53) CYP11B1CYP11B2ALOX15TSHRCASP1
SCHEMBL4652514 0.77 ALOX15 (0.53) CYP11B1CYP11B2ALOX15TSHRCASP1
SCHEMBL4278243 0.77 ALOX15 (0.53) CYP11B1CYP11B2ALOX15TSHRCASP1
SCHEMBL9863750 0.77 ALOX15 (0.53) CYP11B1CYP11B2ALOX15TSHRCASP1
SCHEMBL24784588 0.77 HDAC1 (0.55) CYP11B1CYP11B2ALOX15TSHRCASP1
SCHEMBL5542313 0.77 ALOX15 (0.53) CYP11B1CYP11B2ALOX15TSHRCASP1
SCHEMBL12617050 0.76 HDAC1 (0.53) CYP11B1CYP11B2ALOX15TSHRCASP1
Hydrochloric Acid SCHEMBL9512459 0.75 ALOX15 (0.52) CYP11B1CYP11B2ALOX15TSHRCASP1
SCHEMBL10184678 0.74 HDAC1 (0.56) CYP11B1CYP11B2ALOX15TSHRCASP1

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
US-7291644-B2 Indole derivatives ONO PHARMACEUTICALS CO., LTD. (JP) 2007-11-06 US disclosed
US-7291644-B2 Indole derivatives ONO PHARMACEUTICALS CO., LTD. (JP) 2007-11-06 US disclosed