SCHEMBL28534846

SCHEMBL28534846

CCCCOC(COCC(OCCCC)OCCCC)OCCCC

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
DNM1 Q05193 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
LPAR1 Q92633 4/20 0.35
LPAR3 Q9UBY5 4/20 0.35
LPAR2 Q9HBW0 1/20 0.35
USP2 O75604 1/20 0.34
CYP3A4 P08684 3/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
HPGD P15428 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL9502490 0.92 TSHR (0.42) TSHRADRB2ADRB1ADRB3DNM1
SCHEMBL30534606 0.87 HSD17B10 (0.54) TSHRDNM1LPAR1LPAR3LPAR2
SCHEMBL28131148 0.86 TSHR (0.33) TSHRADRB2ADRB1ADRB3DNM1
SCHEMBL582638 0.86 TSHR (0.33) TSHRADRB2ADRB1ADRB3DNM1
SCHEMBL7040366 0.84 TSHR (0.32) TSHRADRB2ADRB1ADRB3DNM1
SCHEMBL9637324 0.84 TSHR (0.58) TSHRLPAR1LPAR3LPAR2USP2
SCHEMBL582639 0.83 LPAR1 (0.37) TSHRLPAR1LPAR3LPAR2USP2
SCHEMBL1189492 0.83 LPAR1 (0.37) TSHRLPAR1LPAR3LPAR2USP2
SCHEMBL17186653 0.83 TSHR (0.40) TSHRADRB2ADRB1ADRB3DNM1
SCHEMBL9637326 0.83 TSHR (0.56) TSHRLPAR1LPAR3LPAR2USP2

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
US-20250075147-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING NEW FLAVOR AND FRAGRANCE INGREDIENTS OSMO LABS, PBC 2025-03-06 US disclosed
CN-117777632-A Organic carrier for improving screen printing N-type TOPCon front silver-aluminum paste and preparation method of front silver-aluminum paste 江苏聚盈新材料科技有限公司 2024-03-29 CN disclosed
CN-115620935-A Preparation method and application of 2-ethoxyethylamine modified fumed silica organic carrier 西北大学 2023-01-17 CN disclosed
CN-111925277-A Process for separating and purifying sodium formate doped in neopentyl glycol 邓朝茜 2020-11-13 CN disclosed
CN-111925277-A Process for separating and purifying sodium formate doped in neopentyl glycol 邓朝茜 2020-11-13 CN disclosed