SCHEMBL25049547

SCHEMBL25049547

O=C1NCC12CCCNC2

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.42
MAPKAPK2 P49137 11/20 0.33
SIGMAR1 Q99720 2/20 0.31
HTR2A P28223 1/20 0.31
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30
OTUD7B Q6GQQ9 1/20 0.30
BACE1 P56817 1/20 0.30

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
SCHEMBL29680626 1.00 CRBN (0.42) CRBNMAPKAPK2SIGMAR1HTR2AALDH1A1
SCHEMBL1207857 0.87 CRBN (0.47) CRBNMAPKAPK2SIGMAR1HTR2AALDH1A1
SCHEMBL21238835 0.86
SCHEMBL1810656 0.85 CRBN (0.50) CRBNMAPKAPK2SIGMAR1HTR2AALDH1A1
SCHEMBL30633804 0.85 CRBN (0.50) CRBNMAPKAPK2SIGMAR1HTR2AALDH1A1
Hydrochloric Acid SCHEMBL2635798 0.85 CRBN (0.46) CRBNMAPKAPK2SIGMAR1HTR2AALDH1A1
Hydrochloric Acid SCHEMBL2635797 0.85 CRBN (0.46) CRBNMAPKAPK2SIGMAR1HTR2AALDH1A1
SCHEMBL549600 0.85 CRBN (0.50) CRBNMAPKAPK2SIGMAR1HTR2AALDH1A1
SCHEMBL20758531 0.84 CRBN (0.39) CRBNOTUD7B
SCHEMBL21225403 0.83 CRBN (0.44) CRBNALDH1A1CYP1A2CYP3A4CYP2D6

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-20250368649-A1 TETRAHYDROPYRIDOPYRIMIDINE PAN-KRAS INHIBITORS MIRATI THERAPEUTICS INC (US) 2025-12-04 US disclosed
US-12398154-B2 Azaquinazoline pan-KRas inhibitors Mirati Therapeutics, Inc. (US) 2025-08-26 US disclosed
US-20250179077-A1 QUINAZOLINE COMPOUNDS AND USES THEREOF AS INHIBITORS OF MUTANT KRAS PROTEINS AMGEN INC. (US) 2025-06-05 US disclosed
US-20240417412-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2024-12-19 US disclosed
WO-2024054919-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (CN) 2024-03-14 WO disclosed
WO-2024054919-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (CN) 2024-03-14 WO disclosed
EP-4262807-A1 AZAQUINAZOLINE PAN-KRAS INHIBITORS Mirati Therapeutics, Inc. (US) 2023-10-25 EP disclosed
US-20230072276-A1 Azaquinazoline pan-KRas inhibitors Mirati Therapeutics, Inc. 2023-03-09 US disclosed
WO-2023018810-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2023-02-16 WO disclosed
WO-2022132200-A1 AZAQUINAZOLINE PAN-KRAS INHIBITORS Mirati Therapeutics, Inc. (US) 2022-06-23 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 (5 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-20250179077-A1 QUINAZOLINE COMPOUNDS AND USES THEREOF AS INHIBITORS OF MUTANT KRAS PROTEINS KRAS, NRAS, HRAS CRBN 1675/4885MAPKAPK2 455/4885SIGMAR1 4638/4885
US-20240417412-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE KRAS, NRAS, HRAS CRBN 1169/4885MAPKAPK2 840/4885SIGMAR1 4282/4885
US-20250368649-A1 TETRAHYDROPYRIDOPYRIMIDINE PAN-KRAS INHIBITORS KRAS, NRAS, HRAS CRBN 1529/4885MAPKAPK2 1477/4885SIGMAR1 4644/4885
US-20230072276-A1 Azaquinazoline pan-KRas inhibitors KRAS, NRAS, HRAS CRBN 1604/4885MAPKAPK2 1190/4885SIGMAR1 4401/4885
US-12398154-B2 Azaquinazoline pan-KRas inhibitors KRAS, NRAS, HRAS CRBN 1604/4885MAPKAPK2 1190/4885SIGMAR1 4401/4885

“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.