SCHEMBL21237241

SCHEMBL21237241

CC(C)(C)c1cccc2cc(N3CCC(F)C3)ncc12

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CREBBP Q92793 5/20 0.43
▸ HTR3A P46098 1/20 0.37
▸ LRRK2 Q5S007 7/20 0.37
▸ HRH4 Q9H3N8 1/20 0.36
▸ CLK2 P49760 2/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ SCN5A Q14524 1/20 0.35
▸ PIM1 P11309 2/20 0.35
▸ PIM3 Q86V86 2/20 0.35
▸ PIM2 Q9P1W9 2/20 0.35
▸ PDE10A Q9Y233 1/20 0.35
▸ AOC3 Q16853 1/20 0.35
▸ SOS1 Q07889 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
SCHEMBL21237243 0.88 CREBBP (0.43) CREBBPHTR3APDE10A
SCHEMBL21237247 0.88 CREBBP (0.43) CREBBPHTR3APDE10A
SCHEMBL21237388 0.86 CREBBP (0.46) CREBBPHTR3ALRRK2CLK2KCNH2
SCHEMBL21237335 0.86 CREBBP (0.40) CREBBPHTR3ALRRK2PIM1PIM3
SCHEMBL21237249 0.85 HRH4 (0.49) HRH4
SCHEMBL21237184 0.85 CREBBP (0.46) CREBBPLRRK2PDE10A
SCHEMBL21237469 0.85 HRH4 (0.46) CREBBPHRH4PDE10ASOS1
SCHEMBL21237185 0.85 CREBBP (0.46) CREBBPLRRK2PDE10A
SCHEMBL21237513 0.84 CREBBP (0.46) CREBBPHTR3AKCNH2PDE10ASOS1
SCHEMBL19662787 0.84 CREBBP (0.47) CREBBPHTR3ALRRK2PIM1PIM3

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-20220127265-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2022-04-28 — — US disclosed
US-11247989-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2022-02-15 — — US disclosed
US-20190241558-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2019-08-08 — — 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 (3 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-11247989-B2 Therapeutic compounds and uses thereof EP300, HDAC1, CREBBP CREBBP 3/4885HTR3A 3917/4885LRRK2 1327/4885
US-20190241558-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, CREBBP CREBBP 3/4885HTR3A 3917/4885LRRK2 1327/4885
US-20220127265-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, CREBBP CREBBP 3/4885HTR3A 3917/4885LRRK2 1327/4885

“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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