SCHEMBL31201072

SCHEMBL31201072

C=CC(C=C)(C=C)CCCCC

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
ALDH1A1 P00352 1/20 0.41
THRB P10828 1/20 0.39
FDPS P14324 11/20 0.36
GGPS1 O95749 7/20 0.36
CES2 O00748 1/20 0.33
LPAR1 Q92633 1/20 0.33
LPAR3 Q9UBY5 1/20 0.33
SMPD1 P17405 1/20 0.33

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
SCHEMBL17479115 0.97 TSHR (0.48) TSHRALDH1A1THRBFDPSGGPS1
SCHEMBL18240327 0.80 TSHR (0.42) TSHRALDH1A1THRBFDPSGGPS1
SCHEMBL4791137 0.78 TSHR (0.46) TSHRALDH1A1THRBFDPSGGPS1
SCHEMBL1285182 0.78 TSHR (0.40) TSHRALDH1A1THRBFDPSGGPS1
SCHEMBL5333517 0.78 FDPS (0.39) TSHRALDH1A1FDPSGGPS1CES2
SCHEMBL5142088 0.76 TSHR (0.44) TSHRALDH1A1THRBFDPSGGPS1
SCHEMBL16594935 0.76 FDPS (0.40) TSHRALDH1A1THRBFDPSGGPS1
SCHEMBL28367093 0.76 TSHR (0.44) TSHRALDH1A1THRBFDPSGGPS1
SCHEMBL22807004 0.76 TSHR (0.44) TSHRALDH1A1THRBFDPSGGPS1
SCHEMBL10602705 0.76 FDPS (0.41) TSHRALDH1A1FDPSGGPS1CES2

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-4704757-A1 SEMICRYSTALLINE SULFUR CONTAINING POLYMERS FOR ORTHODONTIC APPLICATIONS Align Technology, Inc. (US) 2026-03-11 EP disclosed
US-20250009476-A1 SEMICRYSTALLINE SULFUR CONTAINING POLYMERS FOR ORTHODONTIC APPLICATIONS ALIGN TECHNOLOGY, INC. 2025-01-09 US disclosed
WO-2024233367-A1 SEMICRYSTALLINE SULFUR CONTAINING POLYMERS FOR ORTHODONTIC APPLICATIONS ALIGN TECHNOLOGY, INC. (US) 2024-11-14 WO disclosed