SCHEMBL24229492

SCHEMBL24229492

C[Si](C)(C)CCOCn1c(N2CCc3ccc(OCc4ccccc4)cc3C2)nc2cc(-c3ccccc3)ccc21

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 8/20 0.44
▸ CYP2D6 P10635 3/20 0.38
▸ HRH1 P35367 1/20 0.38
▸ GRIN1 Q05586 1/20 0.38
▸ GRIN2B Q13224 1/20 0.38
▸ PTGES O14684 1/20 0.37
▸ ABCB1 P08183 2/20 0.36
▸ DGAT1 O75907 1/20 0.36
▸ CARM1 Q86X55 1/20 0.36
▸ FFAR1 O14842 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
SCHEMBL24229758 0.92 HRH3 (0.47) HRH3CYP2D6HRH1
SCHEMBL24229708 0.91 HRH3 (0.43) HRH3CYP2D6HRH1CARM1
SCHEMBL24229635 0.89 HRH3 (0.41) HRH3CYP2D6HRH1GRIN1GRIN2B
SCHEMBL24229632 0.88 HDAC6 (0.37) —
SCHEMBL24229576 0.80 BRAF (0.43) —
SCHEMBL29052790 0.80 HRH3 (0.47) HRH3CYP2D6HRH1
SCHEMBL24229711 0.78 TDP1 (0.34) CYP2D6HRH1ABCB1
SCHEMBL29052789 0.78 HRH3 (0.48) HRH3CYP2D6HRH1CARM1
SCHEMBL24229760 0.78 — —
SCHEMBL24239299 0.75 HDAC6 (0.33) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11858930-B2 Fused bicyclic RAF inhibitors and methods for use thereof JAZZ PHARMACEUTICALS IRELAND LIMITED (IE) 2024-01-02 — — US disclosed
US-11858930-B2 Fused bicyclic RAF inhibitors and methods for use thereof JAZZ PHARMACEUTICALS IRELAND LIMITED (IE) 2024-01-02 — — US disclosed
CN-116601150-A Fused bicyclic RAF inhibitors and methods of use thereof 爵士制药爱尔兰有限公司 2023-08-15 — — CN disclosed
WO-2022023447-A2 FUSED BICYCLIC RAF INHIBITORS AND METHODS FOR USE THEREOF JAZZ PHARMACEUTICALS IRELAND LIMITED (IE) 2022-02-03 — — WO disclosed
US-20220033398-A1 FUSED BICYCLIC RAF INHIBITORS AND METHODS FOR USE THEREOF U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS COLLATERAL TRUSTEE 2022-02-03 — — 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 (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-20220033398-A1 FUSED BICYCLIC RAF INHIBITORS AND METHODS FOR USE THEREOF BRAF, RAF1, NRAS HRH3 3556/4885CYP2D6 2672/4885HRH1 2821/4885
US-11858930-B2 Fused bicyclic RAF inhibitors and methods for use thereof BRAF, RAF1, NRAS HRH3 3556/4885CYP2D6 2672/4885HRH1 2821/4885

“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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