SCHEMBL20676597

SCHEMBL20676597

CCC(=O)N1CCC(c2noc(-c3ccc4cnn([C@H]5CCOC5)c4c3)n2)CC1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 6/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ USP7 Q93009 1/20 0.39
▸ USP30 Q70CQ3 1/20 0.39
▸ CREBBP Q92793 2/20 0.38
▸ TBK1 Q9UHD2 4/20 0.37
▸ KIT P10721 1/20 0.37
▸ BRD4 O60885 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ MTOR P42345 1/20 0.37

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
SCHEMBL20676539 1.00 PIK3CD (0.40) PIK3CDSMN1; SMN2USP7USP30CREBBP
SCHEMBL20676662 1.00 PIK3CD (0.40) PIK3CDSMN1; SMN2USP7USP30CREBBP
SCHEMBL20116522 0.94 USP7 (0.41) PIK3CDSMN1; SMN2USP7USP30TBK1
SCHEMBL20676525 0.91 TBK1 (0.45) PIK3CDSMN1; SMN2USP7USP30CREBBP
SCHEMBL22358385 0.91 TBK1 (0.45) PIK3CDSMN1; SMN2USP7USP30CREBBP
SCHEMBL22358410 0.91 TBK1 (0.43) PIK3CDSMN1; SMN2USP7USP30CREBBP
SCHEMBL20116302 0.89 PIK3CD (0.41) PIK3CDSMN1; SMN2USP7USP30CREBBP
SCHEMBL22358038 0.89 PIK3CD (0.41) PIK3CDSMN1; SMN2USP7USP30CREBBP
SCHEMBL20116244 0.89 PIK3CD (0.41) PIK3CDSMN1; SMN2USP7USP30CREBBP
SCHEMBL20676547 0.88 PIK3CD (0.40) PIK3CDSMN1; SMN2USP7USP30CREBBP

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-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 — — US disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 — — US disclosed
US-20200262828-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2020-08-20 — — US disclosed
WO-2019209948-A9 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-01-02 — — WO disclosed
WO-2019018795-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2019-01-24 — — 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-11873298-B2 Compounds and uses thereof NLN, ACHE, CLN6 PIK3CD 3927/4885SMN1; SMN2 13/4885USP7 4265/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 PIK3CD 3927/4885SMN1; SMN2 13/4885USP7 4265/4885

“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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