SCHEMBL28312606

SCHEMBL28312606

CCC(c1ccc(Oc2ccc(C(=O)O)cc2)cc1)c1ccc(Oc2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SRD5A2 P31213 3/20 0.60
▸ PARP15 Q460N3 1/20 0.55
▸ PARP10 Q53GL7 1/20 0.55
▸ RXRA P19793 3/20 0.50
▸ RXRB P28702 3/20 0.50
▸ CA1 P00915 1/20 0.50
▸ CA2 P00918 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ PLA2G4B P0C869 2/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ MAPT P10636 2/20 0.47
▸ HPGD P15428 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ RXRG P48443 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46

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
SCHEMBL938192 0.89 ALDH1A1 (0.56) SRD5A2RXRARXRBCA1CA2
SCHEMBL21656832 0.88 SRD5A2 (0.58) SRD5A2PARP15PARP10RXRARXRB
SCHEMBL27344332 0.83 LMNA (0.50) SRD5A2RXRARXRBTP53TSHR
SCHEMBL5581516 0.81 SRD5A2 (0.64) SRD5A2PARP15PARP10RXRARXRB
SCHEMBL9403898 0.81 RXRA (0.66) SRD5A2PARP15PARP10RXRARXRB
Terephthalic Acid SCHEMBL8675145 0.81 DRD1 (0.61) SRD5A2RXRARXRBCA1CA2
Ethane SCHEMBL11219716 0.80 PARP10 (0.72) SRD5A2PARP15PARP10RXRARXRB
SCHEMBL766069 0.80 PARP10 (0.78) SRD5A2PARP15PARP10RXRARXRB
Terephthalic Acid SCHEMBL9861713 0.80 PARP10 (0.78) SRD5A2PARP15PARP10RXRARXRB
SCHEMBL351082 0.80 POLB (0.55) SRD5A2KMT2AMAPK1RAB9AALDH1A1

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-116606433-A Preparation method and application of heat-resistant transparent polyether amide 湘潭大学 2023-08-18 — — CN disclosed
CN-110121495-A Novel polymer and diamine compound, liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element 日产化学株式会社 2019-08-13 — — CN disclosed
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