SCHEMBL20061111

SCHEMBL20061111

CC(C)c1ccc(-c2cccc3ncccc23)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 3/20 0.55
▸ CA1 P00915 3/20 0.55
▸ CA2 P00918 3/20 0.55
▸ CA9 Q16790 3/20 0.55
▸ ACVR1 Q04771 5/20 0.49
▸ ERN1 O75460 4/20 0.43
▸ SYK P43405 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ AAK1 Q2M2I8 1/20 0.42
▸ BMPR1B O00238 1/20 0.40
▸ BMP4 P12644 1/20 0.40
▸ KDR P35968 1/20 0.40
▸ BMPR1A P36894 1/20 0.40
▸ ACVRL1 P37023 1/20 0.40
▸ DHODH Q02127 1/20 0.40
▸ MCL1 Q07820 1/20 0.39
▸ CNR2 P34972 1/20 0.39
▸ TNKS2 Q9H2K2 1/20 0.39

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
SCHEMBL13524662 0.84 ACVR1 (0.50) CA12CA1CA2CA9ACVR1
SCHEMBL27737402 0.81 CA12 (0.63) CA12CA1CA2CA9ACVR1
SCHEMBL12386951 0.81 CA12 (0.59) CA12CA1CA2CA9ACVR1
SCHEMBL23555710 0.80 CA12 (0.61) CA12CA1CA2CA9ACVR1
SCHEMBL12074247 0.80 CA12 (0.65) CA12CA1CA2CA9ACVR1
SCHEMBL4658401 0.79 CA12 (0.59) CA12CA1CA2CA9ACVR1
SCHEMBL4073648 0.78 CA12 (0.59) CA12CA1CA2CA9ACVR1
SCHEMBL8011323 0.78 CA12 (0.59) CA12CA1CA2CA9ACVR1
SCHEMBL6296099 0.78 CA12 (0.59) CA12CA1CA2CA9ACVR1
SCHEMBL20371605 0.78 KDM4E (0.47) CA12CA1CA2CA9ACVR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180111940-A1 IMIDAZOPYRAZINE DERIVED COMPOUNDS FOR ELECTRONIC DEVICES DOW GLOBAL TECHNOLOGIES LLC (US) 2018-04-26 — — US disclosed
US-20180111940-A1 IMIDAZOPYRAZINE DERIVED COMPOUNDS FOR ELECTRONIC DEVICES DOW GLOBAL TECHNOLOGIES LLC (US) 2018-04-26 — — US disclosed
US-20180108845-A1 CYCLIC UREA COMPOUNDS FOR ELECTRONIC DEVICES DOW GLOBAL TECHNOLOGIES LLC (US) 2018-04-19 — — US disclosed
US-20180108845-A1 CYCLIC UREA COMPOUNDS FOR ELECTRONIC DEVICES DOW GLOBAL TECHNOLOGIES LLC (US) 2018-04-19 — — 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 (2 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-20180111940-A1 IMIDAZOPYRAZINE DERIVED COMPOUNDS FOR ELECTRONIC DEVICES KCNJ2, KCNJ5, IKZF1 CA12 3266/4885CA1 4130/4885CA2 3275/4885
US-20180108845-A1 CYCLIC UREA COMPOUNDS FOR ELECTRONIC DEVICES SLC14A1, ODC1, UROD CA12 3070/4885CA1 2666/4885CA2 3780/4885

“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.

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