SCHEMBL19617224

SCHEMBL19617224

C[C@@H]1CN(c2nc(OCCCN3CCOCC3)nc3c2CCNC3)C[C@H](C)N1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 1/20 0.40
▸ HRH3 Q9Y5N1 5/20 0.40
▸ KRAS P01116 2/20 0.35
▸ USP2 O75604 1/20 0.35
▸ HTR2C P28335 2/20 0.35
▸ HTR2B P41595 1/20 0.35
▸ RAF1 P04049 1/20 0.34
▸ BRAF P15056 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ TLR7 Q9NYK1 1/20 0.34
▸ EPHX2 P34913 1/20 0.33
▸ DHODH Q02127 1/20 0.33
▸ CD274 Q9NZQ7 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL29245850 1.00 MTOR (0.40) MTORHRH3KRASUSP2HTR2C
SCHEMBL19636859 0.90 MTOR (0.38) MTORHRH3KRASRAF1BRAF
SCHEMBL19636856 0.90 MTOR (0.38) MTORHRH3KRASRAF1BRAF
SCHEMBL29246036 0.90 MTOR (0.38) MTORHRH3KRASRAF1BRAF
SCHEMBL29493404 0.90 MTOR (0.38) MTORHRH3KRASRAF1BRAF
SCHEMBL21315023 0.85 MTOR (0.44) MTORHRH3KRASUSP2HTR2C
SCHEMBL19637325 0.82 HTR2C (0.51) MTORHRH3USP2HTR2CHTR2B
SCHEMBL19617015 0.79 TLR9 (0.44) MTORHRH3USP2HTR2CRAF1
SCHEMBL19636864 0.76 HRH3 (0.35) MTORHRH3KRASUSP2HTR2B
SCHEMBL21005672 0.76 MEN1 (0.43) MTORUSP2HTR2CHTR2BPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240101553-A1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2024-03-28 — — US disclosed
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
EP-3710439-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2020-09-23 — — 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
EP-3458445-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2019-03-27 — — EP disclosed
US-10125134-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2018-11-13 — — 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 (9 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 MTOR 1106/4885HRH3 3146/4885KRAS 1/4885
US-10633381-B2 KRas G12C inhibitors KRAS, NRAS, HRAS MTOR 1106/4885HRH3 3146/4885KRAS 1/4885
US-20200262837-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS MTOR 1106/4885HRH3 3146/4885KRAS 1/4885
US-11267812-B2 KRAS G12C inhibitors KRAS, NRAS, HRAS MTOR 1106/4885HRH3 3146/4885KRAS 1/4885
US-10125134-B2 KRas G12C inhibitors KRAS, NRAS, HRAS MTOR 1106/4885HRH3 3146/4885KRAS 1/4885
US-10689377-B2 KRas G12C inhibitors KRAS, NRAS, HRAS MTOR 1106/4885HRH3 3146/4885KRAS 1/4885
US-20240101553-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS MTOR 1106/4885HRH3 3146/4885KRAS 1/4885
US-20180072723-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS MTOR 1106/4885HRH3 3146/4885KRAS 1/4885
US-20230373999-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS MTOR 1106/4885HRH3 3146/4885KRAS 1/4885

“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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