SCHEMBL17673115

SCHEMBL17673115

Clc1cccc2cc(Br)ncc12

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 7/20 0.46
CYP1A2 P05177 2/20 0.43
CYP2A6 P11509 2/20 0.43
NOS1 P29475 2/20 0.36
CHEK2 O96017 4/20 0.34
AHR P35869 1/20 0.34
CCR1 P32246 1/20 0.34
CCR8 P51685 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
FGFR1 P11362 2/20 0.34
SRC P12931 2/20 0.34
IDO1 P14902 1/20 0.34
TDO2 P48775 1/20 0.34
ALDH1A1 P00352 1/20 0.33
CDK1 P06493 1/20 0.33
KCNH2 Q12809 1/20 0.33
NR4A2 P43354 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
SCHEMBL1396867 0.80 CHEK1 (0.48) CHEK1CYP1A2CYP2A6NOS1CHEK2
SCHEMBL1396984 0.77 PDPK1 (0.53) CHEK1CYP1A2CYP2A6NOS1CHEK2
SCHEMBL2748752 0.77 CHEK1 (0.46) CHEK1CYP1A2CYP2A6NOS1CHEK2
SCHEMBL16168207 0.77 CYP1A2 (0.53) CHEK1CYP1A2CYP2A6NOS1CHEK2
SCHEMBL19663432 0.77 KDM4E (0.47) CHEK1CYP1A2CYP2A6CHEK2
SCHEMBL31496225 0.72 CHEK1 (0.42) CHEK1CYP1A2CYP2A6CHEK2L3MBTL1
SCHEMBL5668937 0.71 CYP2A6 (0.62) CHEK1CYP1A2CYP2A6NOS1AHR
SCHEMBL29972350 0.71 CYP2A6 (0.62) CHEK1CYP1A2CYP2A6NOS1AHR
SCHEMBL30930616 0.70 CYP2A6 (0.54) CHEK1CYP1A2CYP2A6L3MBTL1
SCHEMBL427159 0.70 CYP2A6 (0.54) CHEK1CYP1A2CYP2A6L3MBTL1

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 25 patents — showing the first 20. 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
CN-115028617-A Heterocyclic inhibitors of CBP/EP300 and their use in the treatment of cancer 基因泰克公司 2022-09-09 CN disclosed
CN-109476641-B Heterocyclic inhibitors of CBP/EP300 and their use in the treatment of cancer 基因泰克公司 2022-07-05 CN disclosed
US-20220127265-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2022-04-28 US disclosed
EP-3464270-B1 HETEROCYCLIC INHIBITORS OF CBP/EP300 AND THEIR USE IN THE TREATMENT OF CANCER GENENTECH INC (US) 2022-02-23 EP disclosed
EP-3464270-B1 HETEROCYCLIC INHIBITORS OF CBP/EP300 AND THEIR USE IN THE TREATMENT OF CANCER GENENTECH INC (US) 2022-02-23 EP disclosed
US-11247989-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2022-02-15 US disclosed
US-11168070-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2021-11-09 US disclosed
CN-109476663-B Pyrazolopyridine derivatives for the treatment of cancer 基因泰克公司 2021-11-09 CN disclosed
US-20190241558-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2019-08-08 US disclosed
US-20190152949-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2019-05-23 US disclosed
EP-3464286-A1 PYRAZOLOPYRIDINE DERIVATIVES FOR THE TREATMENT OF CANCER Genentech, Inc. (US) 2019-04-10 EP 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
US-10206931-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-02-19 US disclosed
WO-2017205538-A1 PYRAZOLOPYRIDINE DERIVATIVES FOR THE TREATMENT OF CANCER GENENTECH, INC. (US) 2017-11-30 WO disclosed
WO-2017205536-A2 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 WO disclosed
US-20170312292-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF WUXI APPTEC (SHANGHAI) CO. LTD (CN) 2017-11-02 US disclosed
EP-3204360-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF Genentech, Inc. (US) 2017-08-16 EP disclosed
WO-2016055028-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-04-14 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 (7 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 CHEK1 3227/4885CYP1A2 4114/4885CYP2A6 4197/4885
US-20170312292-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, CREBBP, HDAC1 CHEK1 3688/4885CYP1A2 4096/4885CYP2A6 3421/4885
US-20190241558-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, CREBBP CHEK1 3227/4885CYP1A2 4114/4885CYP2A6 4197/4885
US-20190152949-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC11 CHEK1 3258/4885CYP1A2 3649/4885CYP2A6 3623/4885
US-10206931-B2 Therapeutic compounds and uses thereof EP300, CREBBP, HDAC1 CHEK1 3688/4885CYP1A2 4096/4885CYP2A6 3421/4885
US-11168070-B2 Therapeutic compounds and uses thereof EP300, HDAC1, HDAC11 CHEK1 3258/4885CYP1A2 3649/4885CYP2A6 3623/4885
US-20220127265-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, CREBBP CHEK1 3227/4885CYP1A2 4114/4885CYP2A6 4197/4885

“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.