SCHEMBL19637310

SCHEMBL19637310

COc1cc2ccccc2c(N2CCc3c(nc(OCCCN4CCOCC4)nc3N3CCNCC3)C2)c1C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 1/20 0.40
▸ KRAS P01116 7/20 0.40
▸ TLR9 Q9NR96 2/20 0.38
▸ TLR7 Q9NYK1 2/20 0.38
▸ CYP2D6 P10635 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ PDE3B Q13370 1/20 0.36
▸ PDE3A Q14432 1/20 0.36
▸ CHEK1 O14757 2/20 0.35
▸ SRC P12931 2/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.35

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
SCHEMBL19617021 0.93 KRAS (0.42) TOP1KRASTLR9TLR7CYP2D6
SCHEMBL19637302 0.87 KRAS (0.56) KRAS
SCHEMBL19959300 0.86 KRAS (0.45) KRASTLR9TLR7
SCHEMBL19637328 0.85 KRAS (0.42) KRASTLR9TLR7CYP2D6TSHR
SCHEMBL19636852 0.81 KRAS (0.55) KRAS
SCHEMBL30188995 0.80 KRAS (0.56) KRAS
SCHEMBL19637327 0.80 KRAS (0.56) KRAS
SCHEMBL19948571 0.79 KRAS (0.45) KRASTLR9TLR7
SCHEMBL30188700 0.79 KRAS (0.45) KRASTLR9TLR7
SCHEMBL19637307 0.79 KRAS (0.58) KRAS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230373999-A1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2023-11-23 — — US disclosed
EP-3710439-B1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2023-02-15 — — EP disclosed
US-11267812-B2 KRAS G12C inhibitors Mirati Therapeutics, Inc. (US) 2022-03-08 — — US disclosed
EP-3458445-B1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2021-02-17 — — EP disclosed
US-20200262837-A1 KRAS G12C INHIBITORS ARRAY BIOPHARMA INC. 2020-08-20 — — US disclosed
US-10689377-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2020-06-23 — — US disclosed
US-10633381-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2020-04-28 — — US disclosed
US-20190144444-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2019-05-16 — — US disclosed
US-20180072723-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2018-03-15 — — US disclosed
WO-2017201161-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2017-11-23 — — WO 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 (7 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-20190144444-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS TOP1 2798/4885KRAS 1/4885TLR9 4662/4885
US-10633381-B2 KRas G12C inhibitors KRAS, NRAS, HRAS TOP1 2798/4885KRAS 1/4885TLR9 4662/4885
US-20200262837-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS TOP1 2798/4885KRAS 1/4885TLR9 4662/4885
US-11267812-B2 KRAS G12C inhibitors KRAS, NRAS, HRAS TOP1 2798/4885KRAS 1/4885TLR9 4662/4885
US-10689377-B2 KRas G12C inhibitors KRAS, NRAS, HRAS TOP1 2798/4885KRAS 1/4885TLR9 4662/4885
US-20180072723-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS TOP1 2798/4885KRAS 1/4885TLR9 4662/4885
US-20230373999-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS TOP1 2798/4885KRAS 1/4885TLR9 4662/4885

“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.

Send feedback