SCHEMBL9842567

SCHEMBL9842567

C=CCCCCCC1(F)C=CC(c2ccccc2)C(F)=C1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL9842380 0.99
SCHEMBL9842735 0.83 MMP2 (0.33) ALDH1A1
SCHEMBL9842751 0.83 MMP2 (0.33) ALDH1A1
SCHEMBL9842543 0.76
SCHEMBL9842403 0.70 ELANE (0.33)
SCHEMBL9842706 0.67 LTA4H (0.33) USP2ALDH1A1
SCHEMBL1222086 0.62 EDNRA (0.33)
SCHEMBL9842547 0.62 CACNA1D (0.33)
SCHEMBL8754609 0.62 HTR2A (0.36)
Benzene SCHEMBL28134111 0.57 TSHR (0.53) USP2ALDH1A1HPGDTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0413785-A1 LIQUID CRYSTALLINE MEDIA CONTAINING FLUORINATED OLIGOPHENYLS. MERCK PATENT GMBH (DE) 1991-02-27 EP disclosed
WO-1990009420-A1 LIQUID CRYSTALLINE MEDIA CONTAINING FLUORINATED OLIGOPHENYLS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1990-08-23 WO disclosed