SCHEMBL17806214

SCHEMBL17806214

CC(C)N1CCc2c(Cl)cc(-c3cnn(C)c3)cc21

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.36
▸ RET P07949 5/20 0.35
▸ INPPL1 O15357 1/20 0.35
▸ IDH1 O75874 1/20 0.35
▸ LRRK2 Q5S007 2/20 0.34
▸ AXL P30530 1/20 0.34
▸ MET P08581 2/20 0.34
▸ CREBBP Q92793 2/20 0.33
▸ CLK1 P49759 1/20 0.33
▸ DYRK1A Q13627 1/20 0.33
▸ CNR1 P21554 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ CGAS Q8N884 1/20 0.33
▸ KDM1A O60341 1/20 0.33

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
SCHEMBL17806202 0.84 ERN1 (0.43) BRD4INPPL1LRRK2CREBBPDYRK1A
SCHEMBL17809771 0.83 BRD4 (0.39) BRD4RETLRRK2AXLCREBBP
SCHEMBL17806302 0.83 RET (0.42) RETLRRK2
SCHEMBL17806206 0.76 KDM1A (0.48) BRD4LRRK2CREBBPDYRK1AKDM1A
SCHEMBL17806217 0.73 NOTUM (0.51) BRD4LRRK2CREBBPKDM1A
SCHEMBL17806268 0.71 ROCK2 (0.36) BRD4RETLRRK2CREBBP
SCHEMBL17806259 0.71 KDM1A (0.49) BRD4LRRK2CREBBPDYRK1AKDM1A
SCHEMBL17806357 0.71 CREBBP (0.45) BRD4CREBBP
SCHEMBL17806240 0.70 CREBBP (0.38) BRD4RETCREBBP
SCHEMBL17806382 0.69 USP30 (0.55) RETLRRK2CREBBPCNR1CNR2

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-20170333406-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-23 — — US disclosed
US-9763922-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2017-09-19 — — US disclosed
US-20160158207-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-06-09 — — 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-20170333406-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC10 BRD4 11/4885RET 855/4885INPPL1 3124/4885
US-20160158207-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC10 BRD4 11/4885RET 855/4885INPPL1 3124/4885

“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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