SCHEMBL12374367

SCHEMBL12374367

CCOC(=O)c1ccc(N(c2ccc(C)cc2)c2ccc(N(c3ccc(C)cc3)c3ccc(C(=O)OCC)cc3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.61
CA9 Q16790 3/20 0.61
CA12 O43570 2/20 0.61
CA1 P00915 2/20 0.61
CA7 P43166 2/20 0.61
CA14 Q9ULX7 2/20 0.61
ESR1 P03372 1/20 0.61
ESR2 Q92731 1/20 0.61
KMT2A Q03164 2/20 0.59
GAA P10253 1/20 0.59
LMNA P02545 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
MAOA P21397 1/20 0.59
HPGD P15428 4/20 0.53
HTT P42858 2/20 0.53
NPC1 O15118 5/20 0.53
RAB9A P51151 5/20 0.53
MAPT P10636 3/20 0.53
ALDH1A1 P00352 3/20 0.52

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
SCHEMBL5691226 1.00 CA2 (0.61) CA2CA9CA12CA1CA7
SCHEMBL9581449 0.95 CA12 (0.56) CA2CA9CA12CA1CA7
SCHEMBL12544707 0.95 CA12 (0.56) CA2CA9CA12CA1CA7
SCHEMBL235800 0.90 CA2 (0.73) CA2CA9CA12CA1CA7
Hydrochloric Acid SCHEMBL28242785 0.88 CA2 (0.70) CA2CA9CA12CA1CA7
SCHEMBL21784421 0.87 KMT2A (0.61) CA2CA9CA12CA1CA7
SCHEMBL5863155 0.85 CA2 (0.66) CA2CA9CA12CA1CA7
SCHEMBL16351851 0.85 CA2 (0.66) CA2CA9CA12CA1CA7
SCHEMBL87450 0.84 CA1 (0.83) CA2CA9CA12CA1CA7
SCHEMBL22920969 0.84 ALDH1A1 (0.57) CA2CA9CA12CA1CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9331284-B2 Polymer compound and light-emitting device using same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-05-03 US disclosed
US-9269905-B2 Polymer compound having carbon cluster structure and organic device using same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-02-23 US disclosed
US-20130270545-A1 POLYMER COMPOUND HAVING CARBON CLUSTER STRUCTURE AND ORGANIC DEVICE USING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-10-17 US disclosed
US-20120326140-A1 POLYMER COMPOUND AND LIGHT-EMITTING DEVICE USING SAME CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2012-12-27 US disclosed
US-20110187266-A1 POLYMER COMPOUND AND LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-04 US disclosed
US-20110127512-A1 COPOLYMER AND POLYMER LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-02 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-20120326140-A1 POLYMER COMPOUND AND LIGHT-EMITTING DEVICE USING SAME CCNA1, CCNB1, CCNL2 CA2 3443/4885CA9 3140/4885CA12 3679/4885

“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.