SCHEMBL12523367

SCHEMBL12523367

CCN1CCNCC12CC2

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.45
SOS2 Q07890 1/20 0.45
TSHR P16473 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
SCHEMBL21538558 0.85 TSHR (0.42) SOS1SOS2TSHR
SCHEMBL19226779 0.82 SOS1 (0.46) SOS1SOS2TSHR
SCHEMBL25862762 0.82 SOS1 (0.37) SOS1SOS2TSHR
SCHEMBL20758383 0.80 SOS1 (0.48) SOS1SOS2TSHR
SCHEMBL17624763 0.80 SOS1 (0.40) SOS1SOS2TSHR
SCHEMBL25862089 0.80 SOS1 (0.37) SOS1SOS2TSHR
SCHEMBL25792483 0.78 SOS1 (0.41) SOS1SOS2
SCHEMBL6012604 0.76 SOS1 (0.44) SOS1SOS2TSHR
SCHEMBL9801465 0.76 TSHR (0.36) SOS1SOS2TSHR
SCHEMBL24745284 0.75 SOS1 (0.42) SOS1SOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365563-A1 QUINAZOLINE COMPOUND AND APPLICATION THEREOF SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2023-11-16 US disclosed
US-20230227470-A1 ANNULATED 2-AMINO-3-CYANO THIOPHENES AND DERIVATIVES FOR THE TREATMENT OF CANCER VANDERBILT UNIVERSITY 2023-07-20 US disclosed
WO-2022268063-A1 CRYSTAL FORM OF PYRIMIDINE DERIVATIVE AND PREPARATION METHOD THEREFOR 浙江海正药业股份有限公司 2022-12-29 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 (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-20230227470-A1 ANNULATED 2-AMINO-3-CYANO THIOPHENES AND DERIVATIVES FOR THE TREATMENT OF CANCER KRAS, NRAS, TP53 SOS1 1356/4885SOS2 1294/4885TSHR 1257/4885
US-20230365563-A1 QUINAZOLINE COMPOUND AND APPLICATION THEREOF KRAS, NRAS, BRAF SOS1 88/4885SOS2 235/4885TSHR 4687/4885

“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.