SCHEMBL11279883

SCHEMBL11279883

C=CC(Cl)CCCCCC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
LMNA P02545 1/20 0.39
DNM1 Q05193 2/20 0.39
THRB P10828 1/20 0.38
ADH1B P00325 1/20 0.38
ADH1C P00326 1/20 0.38
ADH1A P07327 1/20 0.38
ADH4 P08319 1/20 0.38
ADH7 P40394 1/20 0.38
OPRM1 P35372 1/20 0.37
ALDH1A1 P00352 1/20 0.36
GPR84 Q9NQS5 3/20 0.35
FDPS P14324 3/20 0.35
SPHK1 Q9NYA1 1/20 0.35
FFAR1 O14842 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
SCHEMBL11277038 1.00 TSHR (0.42) TSHRLMNADNM1THRBADH1B
SCHEMBL17005797 1.00 TSHR (0.42) TSHRLMNADNM1THRBADH1B
SCHEMBL11281915 1.00 TSHR (0.42) TSHRLMNADNM1THRBADH1B
SCHEMBL11778733 1.00 TSHR (0.42) TSHRLMNADNM1THRBADH1B
SCHEMBL11779059 1.00 TSHR (0.42) TSHRLMNADNM1THRBADH1B
SCHEMBL11774631 1.00 TSHR (0.42) TSHRLMNADNM1THRBADH1B
SCHEMBL11276000 1.00 TSHR (0.42) TSHRLMNADNM1THRBADH1B
SCHEMBL11776122 1.00 TSHR (0.42) TSHRLMNADNM1THRBADH1B
SCHEMBL11775497 1.00 TSHR (0.42) TSHRLMNADNM1THRBADH1B
SCHEMBL2361753 0.98

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0000555-B1 PROCESS FOR THE PREPARATION OF OXIRANES SUBSTITUTED BY HALOGEN ALKYL BAYER AG (DE) 1982-02-10 EP disclosed
EP-0000554-A1 Process for the preparation of oxiranes substituted by halogen alkyl BAYER AG (DE) 1979-02-07 EP disclosed
EP-0000555-A1 Process for the preparation of oxiranes substituted by halogen alkyl BAYER AG (DE) 1979-02-07 EP disclosed
US-4036896-A FREE RADICAL CATALYST UNIVERSAL OIL PRODUCTS COMPANY (US) 1977-07-19 US disclosed