SCHEMBL20102264

SCHEMBL20102264

CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)cc3)c3cc4ccccc4c4ccccc34)cc21

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
CASP3 P42574 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
ALK Q9UM73 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
SCHEMBL17126415 1.00 HSP90AA1 (0.33) HSP90AA1HSP90AB1CASP3SENP7SENP6
SCHEMBL14295370 0.97 HSP90AA1 (0.31) HSP90AA1HSP90AB1ALK
SCHEMBL14295378 0.97 HSP90AA1 (0.31) HSP90AA1HSP90AB1ALK
SCHEMBL17126428 0.97 HSP90AA1 (0.33) HSP90AA1HSP90AB1CASP3SENP7SENP6
SCHEMBL20102241 0.96 PLA2G2A (0.32)
SCHEMBL17126371 0.96 HSP90AA1 (0.31) HSP90AA1HSP90AB1
SCHEMBL17126664 0.94 CASP3 (0.31) HSP90AA1HSP90AB1CASP3SENP7SENP6
SCHEMBL20102253 0.94 HCRTR1 (0.33)
SCHEMBL10110068 0.94 PLA2G2A (0.34) HSP90AA1HSP90AB1ALK
SCHEMBL17126750 0.94 PLA2G2A (0.34) HSP90AA1HSP90AB1ALK

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
US-20180123042-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-03 US disclosed
US-20180123042-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-03 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-20180123042-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE COMPRISING SAME OR10J3, BMI1, ETV6 HSP90AA1 4855/4885HSP90AB1 4877/4885CASP3 2499/4885

“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.