SCHEMBL8964087

SCHEMBL8964087

CC1OC1Oc1ccccc1OC(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.41
ALDH1A1 P00352 2/20 0.35
NR1I2 O75469 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HTR1A P08908 2/20 0.33
KCNN4 O15554 1/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
ALOX12 P18054 1/20 0.33
HTT P42858 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A3 Q01959 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
LMNA P02545 1/20 0.32
ALPL P05186 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
SCHEMBL93243 0.77 CA1 (0.54) ALDH1A1KMT2AADRA2BHTTSLC6A2
SCHEMBL4654255 0.76 DRD1 (0.48) DRD1ALDH1A1NR1I2KDM4EGAA
SCHEMBL1698265 0.73 ALDH1A1 (0.46) ALDH1A1KDM4EHTR1ASLC6A2SLC6A3
SCHEMBL19527662 0.73 PDE4D (0.43) DRD1ALDH1A1KDM4EKMT2ASMN1; SMN2
SCHEMBL28355135 0.72 HRH1 (0.47) ALDH1A1KDM4ESMN1; SMN2ADRA2AADRA2B
SCHEMBL7806133 0.72 SLC6A4 (0.42) KDM4ESMN1; SMN2HTR1AHTTSLC6A2
SCHEMBL20064142 0.70 PDE4B (0.47) DRD1KDM4EKMT2AHTR1AADRA2A
SCHEMBL28693925 0.70 LMNA (0.33) ALDH1A1KDM4ELMNA
SCHEMBL23813151 0.70 ALDH1A1 (0.48) DRD1ALDH1A1KDM4EGAAKMT2A
SCHEMBL9527314 0.70 CA1 (0.62) ALDH1A1KDM4EGAAKMT2AKCNN4

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-0695293-A1 10,11-METHANODIBENZOSUBERANE DERIVATIVES USED AS CHEMOSENSITIZING AGENTS SYNTEX (U.S.A.) INC. (US) 1996-02-07 EP disclosed
WO-1994024107-A1 10,11-METHANODIBENZOSUBERANE DERIVATIVES USED AS CHEMOSENSITIZING AGENTS SYNTEX (U.S.A.) INC. (US) 1994-10-27 WO disclosed