SCHEMBL21237388

SCHEMBL21237388

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

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CREBBP Q92793 6/20 0.46
▸ SOS1 Q07889 6/20 0.35
▸ HTR3A P46098 1/20 0.34
▸ PDE10A Q9Y233 1/20 0.34
▸ LRRK2 Q5S007 3/20 0.33
▸ PDE2A O00408 1/20 0.33
▸ PDE3A Q14432 1/20 0.33
▸ CLK2 P49760 2/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ SCN5A Q14524 1/20 0.32

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
SCHEMBL21237241 0.86 CREBBP (0.43) CREBBPSOS1HTR3APDE10ALRRK2
SCHEMBL19662790 0.85 CREBBP (0.50) CREBBPSOS1HTR3APDE10ALRRK2
SCHEMBL21237247 0.84 CREBBP (0.43) CREBBPHTR3APDE10A
SCHEMBL21237243 0.84 CREBBP (0.43) CREBBPHTR3APDE10A
SCHEMBL21237250 0.83 CREBBP (0.49) CREBBPSOS1HTR3APDE10APDE3A
SCHEMBL21237184 0.81 CREBBP (0.46) CREBBPPDE10ALRRK2PDE3A
SCHEMBL21237249 0.81 HRH4 (0.49) —
SCHEMBL21237469 0.81 HRH4 (0.46) CREBBPSOS1PDE10A
SCHEMBL21237185 0.81 CREBBP (0.46) CREBBPPDE10ALRRK2PDE3A
SCHEMBL21237335 0.80 CREBBP (0.40) CREBBPSOS1HTR3ALRRK2

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 3/4885SOS1 3470/4885HTR3A 3917/4885
US-20190241558-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, CREBBP CREBBP 3/4885SOS1 3470/4885HTR3A 3917/4885
US-20220127265-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, CREBBP CREBBP 3/4885SOS1 3470/4885HTR3A 3917/4885

“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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