SCHEMBL19644337

SCHEMBL19644337

CCOC(=O)C1CCc2[nH]nc(Br)c2C1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.43
POLB P06746 2/20 0.40
LIMK1 P53667 1/20 0.40
CDK2 P24941 1/20 0.39
FLT3 P36888 1/20 0.39
CCNA1 P78396 1/20 0.39
GAA P10253 1/20 0.36
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 2/20 0.36
MAPT P10636 2/20 0.36
TP53 P04637 1/20 0.36
MAPK1 P28482 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HCAR2 Q8TDS4 1/20 0.34

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
SCHEMBL8096780 0.75 ALDH1A1 (0.46) PDK1LIMK1CDK2FLT3CCNA1
SCHEMBL30807464 0.73 PDK1 (0.47) PDK1POLBLIMK1CDK2FLT3
SCHEMBL27138888 0.73 PDK1 (0.47) PDK1POLBLIMK1CDK2FLT3
SCHEMBL1417741 0.72 DRD2 (0.48) PDK1LIMK1CDK2FLT3CCNA1
SCHEMBL17338741 0.72 PDK1 (0.46) PDK1POLBLIMK1CDK2FLT3
SCHEMBL8088072 0.71 LIMK1 (0.45) PDK1LIMK1CDK2FLT3CCNA1
SCHEMBL15995924 0.70 KDM4E (0.43) PDK1LIMK1CDK2FLT3CCNA1
SCHEMBL15995438 0.70 SIRT1 (0.47) CDK2FLT3CCNA1GAAALDH1A1
SCHEMBL20601994 0.70 SIRT1 (0.58) GAAALDH1A1MAPTMAPK1MEN1
SCHEMBL2225105 0.70 KDM4E (0.46) CDK2FLT3CCNA1GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4067347-B1 HETEROCYCLIC INHIBITORS OF CBP/EP300 FOR THE TREATMENT OF CANCER GENENTECH INC (US) 2024-06-19 EP disclosed
EP-4067347-A1 HETEROCYCLIC INHIBITORS OF CBP/EP300 FOR THE TREATMENT OF CANCER Genentech, Inc. (US) 2022-10-05 EP disclosed
US-11168070-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2021-11-09 US disclosed
US-20200399244-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2020-12-24 US disclosed
US-10696655-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2020-06-30 US disclosed
US-20190152949-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2019-05-23 US disclosed
EP-3464270-A2 HETEROCYCLIC INHIBITORS OF CBP/EP300 AND THEIR USE IN THE TREATMENT OF CANCER Genentech, Inc. (US) 2019-04-10 EP disclosed
WO-2017205536-A2 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 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 (4 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-20200399244-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC3 PDK1 615/4885POLB 2200/4885LIMK1 2854/4885
US-20190152949-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC11 PDK1 511/4885POLB 2256/4885LIMK1 2688/4885
US-11168070-B2 Therapeutic compounds and uses thereof EP300, HDAC1, HDAC11 PDK1 511/4885POLB 2256/4885LIMK1 2688/4885
US-10696655-B2 Therapeutic compounds and uses thereof EP300, HDAC1, HDAC11 PDK1 511/4885POLB 2256/4885LIMK1 2688/4885

“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.