SCHEMBL26419299

SCHEMBL26419299

CCN1CCCC12CN(C(C)(C)C)C2

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
ROCK2 O75116 1/20 0.30
ROCK1 Q13464 1/20 0.30
CDC42BPA Q5VT25 1/20 0.30
CDC42BPB Q9Y5S2 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
SCHEMBL18806171 0.89 ROCK2 (0.31) CRHBPCRHR2ROCK2ROCK1CDC42BPA
SCHEMBL19498072 0.88 CRHBP (0.38) CRHBPCRHR2
SCHEMBL26419874 0.85 GRIN2D (0.34)
SCHEMBL26419294 0.80 CRHBP (0.30) CRHBPCRHR2
SCHEMBL26419295 0.80 CRHBP (0.30) CRHBPCRHR2
SCHEMBL26419355 0.79
SCHEMBL26419292 0.79 HSD11B1 (0.36)
SCHEMBL24091654 0.78 CRHBP (0.33) CRHBPCRHR2
SCHEMBL26419854 0.78 CRHBP (0.33) CRHBPCRHR2
SCHEMBL21233967 0.78 ROCK2 (0.32) ROCK2ROCK1CDC42BPACDC42BPB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230128824-A1 SPIRO RING-CONTAINING QUINAZOLINE COMPOUND Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2023-04-27 US disclosed
US-20230128824-A1 SPIRO RING-CONTAINING QUINAZOLINE COMPOUND Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2023-04-27 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 (1 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-20230128824-A1 SPIRO RING-CONTAINING QUINAZOLINE COMPOUND KRAS, NRAS, HRAS CRHBP 3609/4885CRHR2 3865/4885ROCK2 519/4885

“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.