SCHEMBL28412889

SCHEMBL28412889

Nc1ccc(Oc2cccc(C(=O)c3ccc(-c4ccccc4)cc3)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRD5A2 P31213 2/20 0.54
▸ AKR1C3 P42330 1/20 0.54
▸ PARP10 Q53GL7 3/20 0.54
▸ TNKS O95271 1/20 0.54
▸ PARP15 Q460N3 1/20 0.54
▸ PARP14 Q460N5 1/20 0.54
▸ TNKS2 Q9H2K2 1/20 0.54
▸ PARP2 Q9UGN5 1/20 0.54
▸ POLB P06746 1/20 0.54
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ MITF O75030 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ GAA P10253 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ GFER P55789 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ NLRP1 Q9C000 1/20 0.51
▸ NOD2 Q9HC29 1/20 0.51
▸ PBRM1 Q86U86 1/20 0.51

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
SCHEMBL7802758 0.91 PARP10 (0.63) SRD5A2AKR1C3PARP10TNKSPARP15
SCHEMBL308153 0.91 PARP10 (0.63) SRD5A2AKR1C3PARP10TNKSPARP15
SCHEMBL8904694 0.91 PARP10 (0.63) SRD5A2AKR1C3PARP10TNKSPARP15
SCHEMBL10067183 0.90 SRD5A2 (0.61) SRD5A2PARP10POLBMEN1KMT2A
SCHEMBL10067180 0.89 MAOB (0.62) SRD5A2AKR1C3PARP10TNKSPARP15
SCHEMBL310329 0.88 ALDH1A1 (0.66) AKR1C3PARP10TNKSPARP15PARP14
SCHEMBL29436294 0.88 ALDH1A1 (0.66) AKR1C3PARP10TNKSPARP15PARP14
SCHEMBL8903435 0.88 ALDH1A1 (0.66) AKR1C3PARP10TNKSPARP15PARP14
SCHEMBL8907997 0.87 ALDH1A1 (0.63) AKR1C3PARP10TNKSPARP15PARP14
SCHEMBL2868057 0.87 SRD5A2 (0.70) SRD5A2AKR1C3PARP10TNKSPARP15

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
CN-111303418-B Photo-crosslinkable polyimide resin 上海极紫科技有限公司 2023-05-09 — — CN disclosed
CN-111303418-A Photocrosslinkable polyimide resin 上海极紫科技有限公司 2020-06-19 — — CN disclosed
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