SCHEMBL8206027

SCHEMBL8206027

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

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL11566780 0.76
SCHEMBL11103689 0.76 TSHR (0.33) TSHRALDH1A1
SCHEMBL11809553 0.75 TSHR (0.41) TSHRALDH1A1
SCHEMBL7080231 0.75 TSHR (0.37) TSHRALDH1A1
SCHEMBL15233851 0.71 TSHR (0.39) TSHRALDH1A1
SCHEMBL139284 0.71
SCHEMBL8858665 0.70 TSHR (0.40) TSHRALDH1A1
SCHEMBL8744932 0.70 TSHR (0.40) TSHRALDH1A1
SCHEMBL10381189 0.67 TSHR (0.57) TSHRALDH1A1
SCHEMBL8071528 0.67 TSHR (0.36) TSHRALDH1A1

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
US-6127309-A Catalyst for use in the alkylation of isoalkanes NIPPON OIL CO., LTD. (JP) 2000-10-03 US disclosed
US-5968868-A Catalyst for use in the alkylation of isoalkanes NIPPON OIL CO., LTD. (JP) 1999-10-19 US disclosed
US-3987089-A PLATINUM GROUP METAL SALT CATALYST, REOXIDIZING AGENT ROHM AND HAAS COMPANY (US) 1976-10-19 US disclosed