SCHEMBL27752152

SCHEMBL27752152

CCCCc1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)n2-c2ccccc2)cc1.CCCCc1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)n2-c2ccccc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.73
UCHL3 P15374 2/20 0.59
AVPR1A P37288 1/20 0.58
HPGD P15428 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
TSHR P16473 2/20 0.50
OXTR P30559 1/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HSD17B10 Q99714 1/20 0.46
RARB P10826 1/20 0.45
GLA P06280 1/20 0.45

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
SCHEMBL195220 1.00 HSD11B1 (0.73) HSD11B1UCHL3AVPR1AHPGDSMN1; SMN2
SCHEMBL23846180 0.97 HSD11B1 (0.72) HSD11B1UCHL3AVPR1AHPGDSMN1; SMN2
SCHEMBL30784891 0.92 HSD11B1 (0.66) HSD11B1UCHL3AVPR1AHPGDSMN1; SMN2
SCHEMBL14533545 0.88 HSD11B1 (0.64) HSD11B1UCHL3AVPR1AHPGDSMN1; SMN2
SCHEMBL14975277 0.88 HSD11B1 (0.60) HSD11B1UCHL3AVPR1AHPGDSMN1; SMN2
SCHEMBL10035337 0.87 HSD11B1 (0.60) HSD11B1UCHL3AVPR1AHPGDSMN1; SMN2
SCHEMBL10035324 0.87 HSD11B1 (0.60) HSD11B1UCHL3AVPR1AHPGDSMN1; SMN2
SCHEMBL10111051 0.87 HSD11B1 (0.63) HSD11B1UCHL3AVPR1AHPGDSMN1; SMN2
SCHEMBL10110923 0.85 HSD11B1 (0.56) HSD11B1UCHL3AVPR1AHPGDSMN1; SMN2
SCHEMBL10035345 0.84 HSD11B1 (0.56) HSD11B1UCHL3KDM4EALDH1A1

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
CN-101364636-A Organic electroluminescent device UNIV TSINGHUA (CN) 2009-02-11 CN disclosed