SCHEMBL30361992

SCHEMBL30361992

Brc1ccc2ccccc2c1-c1c(Br)ccc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.55
▸ CYP2A6 P11509 5/20 0.55
▸ HSD17B10 Q99714 4/20 0.55
▸ TSHR P16473 3/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ HPRT1 P00492 1/20 0.50
▸ DNMT1 P26358 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ MAPT P10636 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ CYP1B1 Q16678 1/20 0.46
▸ WDR5 P61964 1/20 0.45
▸ CYP1A2 P05177 4/20 0.41
▸ PTPN22 Q9Y2R2 1/20 0.41
▸ PAX8 Q06710 1/20 0.41
▸ CES1 P23141 1/20 0.41
▸ HPGD P15428 2/20 0.40
▸ THRB P10828 1/20 0.40
▸ GPR84 Q9NQS5 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39

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
SCHEMBL1239327 1.00 ALDH1A1 (0.55) ALDH1A1CYP2A6HSD17B10TSHRTDP1
SCHEMBL4423942 0.87 ALDH1A1 (0.47) ALDH1A1CYP2A6HSD17B10TSHRTDP1
SCHEMBL13839779 0.87 TSHR (0.52) ALDH1A1CYP2A6HSD17B10TSHRTDP1
SCHEMBL18965318 0.87 ALDH1A1 (0.42) ALDH1A1CYP2A6HSD17B10TSHRTDP1
SCHEMBL31543984 0.86 ALDH1A1 (0.46) ALDH1A1CYP2A6HSD17B10TSHRTDP1
SCHEMBL18320175 0.86 ALDH1A1 (0.46) ALDH1A1CYP2A6HSD17B10TSHRTDP1
SCHEMBL369327 0.84 DNMT1 (0.50) ALDH1A1CYP2A6HSD17B10TSHRTDP1
SCHEMBL30125426 0.84 DNMT1 (0.50) ALDH1A1CYP2A6HSD17B10TSHRTDP1
SCHEMBL10384451 0.84 DNMT1 (0.50) ALDH1A1CYP2A6HSD17B10TSHRTDP1
SCHEMBL9212726 0.83 HSD17B10 (0.48) ALDH1A1CYP2A6HSD17B10TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119823165-A Dinaphthosilole compound, synthesis method and application thereof in fluorescence detection of nitroaromatic ring compound 亳州学院 2025-04-15 — — CN claimed
CN-119823165-A Dinaphthosilole compound, synthesis method and application thereof in fluorescence detection of nitroaromatic ring compound 亳州学院 2025-04-15 — — CN disclosed
CN-118271216-A Synthesis method of 2,2' -dithio (seleno) biaryl derivative 中南大学 2024-07-02 — — CN disclosed
CN-113195558-B Polyolefin and method for producing same 韩华思路信株式会社 2023-10-03 — — CN disclosed
CN-111836836-B Transition metal compound for olefin polymerization catalyst, catalyst and polyolefin polymerized by using the catalyst 韩华思路信株式会社 2023-04-28 — — CN disclosed
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