SCHEMBL18486995

SCHEMBL18486995

Cc1nc(CF)cc(C(F)(F)F)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
ATM Q13315 3/20 0.34
HSD17B10 Q99714 3/20 0.34
KDM4E B2RXH2 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HTT P42858 1/20 0.34
CYP2C19 P33261 3/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2D6 P10635 1/20 0.33
TSHR P16473 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
FABP4 P15090 2/20 0.31
CYP1A2 P05177 2/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 3/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SDHB P21912 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
SCHEMBL10271825 0.80 HSP90AA1 (0.52) HSP90AA1HSP90AB1ATMHSD17B10KDM4E
SCHEMBL18051753 0.80 HSP90AA1 (0.41) HSP90AA1HSP90AB1ATMHSD17B10KDM4E
SCHEMBL14927263 0.74 HSP90AA1 (0.63) HSP90AA1HSP90AB1ATMHSD17B10KDM4E
SCHEMBL3939261 0.73 HPGD (0.41) HSD17B10KDM4EKMT2AHTTCYP1A2
Ammonia Solution, Strong SCHEMBL15795498 0.72 HSP90AA1 (0.61) HSP90AA1HSP90AB1ATMHSD17B10KDM4E
SCHEMBL24355364 0.71 HSP90AA1 (0.53) HSP90AA1HSP90AB1HSD17B10KDM4EKMT2A
SCHEMBL9519045 0.71 HSP90AA1 (0.44) HSP90AA1HSP90AB1ATMHSD17B10KDM4E
SCHEMBL603692 0.71 HSP90AA1 (0.44) HSP90AA1HSP90AB1ATMHSD17B10KDM4E
SCHEMBL18248761 0.71 HSP90AA1 (0.44) HSP90AA1HSP90AB1ATMHSD17B10KDM4E
SCHEMBL28853428 0.71 HSP90AA1 (0.44) HSP90AA1HSP90AB1ATMHSD17B10KDM4E

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
US-20170040547-A1 SPIRALLY CONFIGURED CIS-STILBENE/FLUORENE HYBRID COMPOUNDS AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME NICHEM FINE TECHNOLOGY CO., LTD. (TW) 2017-02-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170040547-A1 SPIRALLY CONFIGURED CIS-STILBENE/FLUORENE HYBRID COMPOUNDS AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME SLCO2B1, SLCO4C1, SLCO1B1 HSP90AA1 3652/4885HSP90AB1 3058/4885ATM 4174/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.