SCHEMBL7722585

SCHEMBL7722585

CCc1cc(F)c(C(F)(F)Oc2ccc(CCc3cc(F)c(F)c(F)c3)cc2)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.36
GPR84 Q9NQS5 1/20 0.35
TSHR P16473 1/20 0.34
SLC6A4 P31645 5/20 0.33
SLC6A3 Q01959 4/20 0.33
MAOB P27338 1/20 0.33
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 1/20 0.32
TUBA4A P68366 1/20 0.32
TUBB4B P68371 1/20 0.32
TUBB3 Q13509 1/20 0.32
TUBB2A Q13885 1/20 0.32
TUBB8 Q3ZCM7 1/20 0.32
TUBA3E Q6PEY2 1/20 0.32
TUBA1A Q71U36 1/20 0.32
TUBA1C Q9BQE3 1/20 0.32
TUBB6 Q9BUF5 1/20 0.32
TUBB2B Q9BVA1 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
SCHEMBL7734936 0.92 THRB (0.36) DAOGPR84TSHRSLC6A4SLC6A3
SCHEMBL7730765 0.92 DAO (0.38) DAOGPR84TSHRSLC6A4SLC6A3
SCHEMBL7730403 0.89 S1PR1 (0.36) DAO
SCHEMBL14749507 0.88 TSHR (0.39) DAOTSHRSLC6A4SLC6A3TAAR1
SCHEMBL7734977 0.88 DAO (0.40) DAOGPR84TSHRSLC6A4SLC6A3
SCHEMBL7729128 0.88 THRB (0.40) SLC6A4SLC6A3ALDH1A1
SCHEMBL7730202 0.86 DAO (0.36) DAOGPR84TSHRSLC6A4SLC6A3
SCHEMBL7732941 0.86 PRMT6 (0.35) TSHRMAOBP2RX7
SCHEMBL7730572 0.86 TRPV4 (0.33) DAOGPR84TSHRSLC6A4SLC6A3
SCHEMBL7731620 0.85 MAOB (0.32) MAOBP2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0786445-B1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORP (JP) 2002-07-17 EP disclosed