SCHEMBL29399322

SCHEMBL29399322

C=Cc1ccccc1C1=Cc2ccccc2C1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 3/20 0.53
▸ CYP11B2 P19099 3/20 0.41
▸ CYP11B1 P15538 2/20 0.41
▸ GPR84 Q9NQS5 2/20 0.38
▸ DRD2 P14416 4/20 0.38
▸ DRD4 P21917 3/20 0.38
▸ IP6K1 Q92551 1/20 0.35
▸ IP6K3 Q96PC2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ MTNR1A P48039 1/20 0.33
▸ MTNR1B P49286 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ ADRA1D P25100 1/20 0.32
▸ ADRA1A P35348 1/20 0.32
▸ ADRA1B P35368 1/20 0.32
▸ CYP19A1 P11511 1/20 0.31

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
SCHEMBL22557620 1.00 PTGS2 (0.53) PTGS2CYP11B2CYP11B1GPR84DRD2
SCHEMBL29672905 0.81 PTGS2 (0.67) PTGS2CYP11B2CYP11B1GPR84DRD2
SCHEMBL7180542 0.81 PTGS2 (0.67) PTGS2CYP11B2CYP11B1GPR84DRD2
SCHEMBL29606538 0.79 PTGS2 (0.65) PTGS2CYP11B2CYP11B1GPR84DRD2
SCHEMBL7172726 0.79 PTGS2 (0.65) PTGS2CYP11B2CYP11B1GPR84DRD2
Hydrochloric Acid SCHEMBL29672906 0.77 PTGS2 (0.62) PTGS2CYP11B2CYP11B1GPR84DRD2
Hydrochloric Acid SCHEMBL17835934 0.77 PTGS2 (0.62) PTGS2CYP11B2CYP11B1GPR84DRD2
Hydrochloric Acid SCHEMBL29962972 0.76 PTGS2 (0.61) PTGS2CYP11B2CYP11B1GPR84DRD2
Hydrochloric Acid SCHEMBL16516153 0.76 PTGS2 (0.61) PTGS2CYP11B2CYP11B1GPR84DRD2
Hydrochloric Acid SCHEMBL30769635 0.76 PTGS2 (0.61) PTGS2CYP11B2CYP11B1GPR84DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3956334-B1 COMPOUNDS FOR OPTICALLY ACTIVE DEVICES AMO Ireland (IE) 2025-09-24 — — EP claimed
CN-113692407-B Compounds for optically active devices 爱尔兰眼力健公司 2024-09-13 — — CN disclosed
EP-3956334-A1 COMPOUNDS FOR OPTICALLY ACTIVE DEVICES Merck Patent GmbH (DE) 2022-02-23 — — EP disclosed
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