SCHEMBL28384637

SCHEMBL28384637

O=CC1Cc2ccccc2N1c1c(Cl)cccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 6/20 0.39
▸ AADAT Q8N5Z0 1/20 0.38
▸ MAPK14 Q16539 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ DRD2 P14416 4/20 0.36
▸ DRD4 P21917 3/20 0.36
▸ DRD3 P35462 1/20 0.34
▸ SLC22A12 Q96S37 1/20 0.34

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
SCHEMBL28317897 0.70 NOTUM (0.38) NOTUMAADATALDH1A1DRD2DRD4
SCHEMBL28491796 0.68 CHRM2 (0.41) NOTUMAADATALDH1A1DRD2DRD4
SCHEMBL27383076 0.67 ACE (0.39) NOTUM
SCHEMBL28735654 0.67 NOTUM (0.36) NOTUMAADATALDH1A1DRD2DRD4
SCHEMBL4275949 0.67 NOTUM (0.49) NOTUMALDH1A1
SCHEMBL7554141 0.67 NOTUM (0.49) NOTUMALDH1A1
SCHEMBL27855041 0.66 AADAT (0.37) NOTUMAADATALDH1A1DRD2DRD4
SCHEMBL28280223 0.64 ADRA2A (0.41) NOTUMAADATDRD2DRD3
SCHEMBL27776797 0.64 LMNA (0.52) ALDH1A1DRD2DRD3
SCHEMBL15181288 0.63 GAA (0.38) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114516813-A Continuous flow preparation method of diclofenac sodium 复旦大学 2022-05-20 — — CN claimed
CN-111100057-B Method for synthesizing diclofenac sodium intermediate 1- (2, 6-dichlorophenyl) indoline-2-ketone 天方药业有限公司 2021-06-11 — — CN claimed
CN-111100057-A Method for synthesizing diclofenac sodium intermediate 1- (2, 6-dichlorophenyl) indoline-2-ketone 天方药业有限公司 2020-05-05 — — CN claimed
CN-113429308-B Synthesis process of diclofenac sodium 安徽普利药业有限公司 2023-07-18 — — CN disclosed
CN-114539086-A Method for synthesizing diclofenac sodium 复旦大学 2022-05-27 — — CN disclosed
CN-114516813-A Continuous flow preparation method of diclofenac sodium 复旦大学 2022-05-20 — — CN disclosed
CN-113429308-A Process for synthesizing diclofenac sodium 安徽普利药业有限公司 2021-09-24 — — CN disclosed
CN-111100057-B Method for synthesizing diclofenac sodium intermediate 1- (2, 6-dichlorophenyl) indoline-2-ketone 天方药业有限公司 2021-06-11 — — CN disclosed
CN-111100057-B Method for synthesizing diclofenac sodium intermediate 1- (2, 6-dichlorophenyl) indoline-2-ketone 天方药业有限公司 2021-06-11 — — CN disclosed
CN-111100057-B Method for synthesizing diclofenac sodium intermediate 1- (2, 6-dichlorophenyl) indoline-2-ketone 天方药业有限公司 2021-06-11 — — CN disclosed
CN-111100057-A Method for synthesizing diclofenac sodium intermediate 1- (2, 6-dichlorophenyl) indoline-2-ketone 天方药业有限公司 2020-05-05 — — CN disclosed
CN-111100057-A Method for synthesizing diclofenac sodium intermediate 1- (2, 6-dichlorophenyl) indoline-2-ketone 天方药业有限公司 2020-05-05 — — CN disclosed
CN-111100057-A Method for synthesizing diclofenac sodium intermediate 1- (2, 6-dichlorophenyl) indoline-2-ketone 天方药业有限公司 2020-05-05 — — CN disclosed
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