SCHEMBL18396207

SCHEMBL18396207

O=c1[nH][nH]c2ccc(Br)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 1.00
PIM1 P11309 2/20 1.00
FLT3 P36888 2/20 1.00
JAK2 O60674 2/20 1.00
AURKA O14965 1/20 1.00
DAPK3 O43293 1/20 1.00
PRKD3 O94806 1/20 1.00
MAP4K4 O95819 1/20 1.00
PAK4 O96013 1/20 1.00
ABL1 P00519 1/20 1.00
NTRK1 P04629 1/20 1.00
CSF1R P07333 1/20 1.00
RET P07949 1/20 1.00
MET P08581 1/20 1.00
PDGFRB P09619 1/20 1.00
FGFR1 P11362 1/20 1.00
PDGFRA P16234 1/20 1.00
PRKACA P17612 1/20 1.00
FLT1 P17948 1/20 1.00
LTK P29376 1/20 1.00

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
SCHEMBL15333160 0.83 METAP2 (1.00) CHEK1PIM1FLT3JAK2AURKA
SCHEMBL31456431 0.83 METAP2 (1.00) CHEK1PIM1FLT3JAK2AURKA
SCHEMBL2457623 0.82 CHEK1 (0.69) CHEK1PIM1FLT3JAK2AURKA
SCHEMBL182445 0.75 JAK2 (0.60) CHEK1PIM1FLT3JAK2AURKA
SCHEMBL612899 0.74 DAO (0.70) CHEK1PIM1FLT3JAK2AURKA
SCHEMBL12241447 0.74 CHEK1 (0.59) CHEK1PIM1FLT3JAK2AURKA
SCHEMBL3924921 0.74 CHEK1 (0.59) CHEK1PIM1FLT3JAK2AURKA
SCHEMBL4950054 0.74 DAO (0.70) CHEK1PIM1FLT3JAK2AURKA
SCHEMBL3906637 0.74 RPS6KA3 (0.59) CHEK1PIM1FLT3JAK2AURKA
SCHEMBL1396317 0.72 CHEK1 (0.56) CHEK1PIM1FLT3JAK2AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025235733-A1 BIS-BICYCLOHETEROARYL MACROCYCLES AND THEIR USE BLOSSOMHILL THERAPEUTICS, INC. (US) 2025-11-13 WO disclosed
EP-4558492-A1 3-(6-PYRIDIN-3-YL)-2-[4-(4-METHYL-4H-1,2,4-TRIAZOL-3-YL)PIPERIDIN-1-YL]BENZONITRILE DERIVATIVES AND SIMILAR COMPOUNDS AS QPCTL AND QPCT INHIBITORS FOR THE TREATMENT OF CANCER 858 Therapeutics, Inc. (US) 2025-05-28 EP disclosed
EP-4330257-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS FOR ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2025-03-19 EP disclosed
CN-119654315-A 3- (6-Pyridin-3-yl) -2- [4- (4-methyl-4H-1, 2, 4-triazol-3-yl) piperidin-1-yl ] benzonitrile derivatives and similar compounds as QPCTL and QPCT inhibitors for the treatment of cancer 858治疗公司 2025-03-18 CN disclosed
US-20240246983-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2024-07-25 US disclosed
US-20240101544-A1 INHIBITORS OF QPCTL AND QPCT 858 THERAPEUTICS, INC. 2024-03-28 US disclosed
WO-2024020517-A1 3-(6-PYRIDIN-3-YL)-2-[4-(4-METHYL-4H-1,2,4-TRIAZOL-3-YL)PIPERIDIN-1-YL]BENZONITRILE DERIVATIVES AND SIMILAR COMPOUNDS AS QPCTL AND QPCT INHIBITORS FOR THE TREATMENT OF CANCER 858 THERAPEUTICS, INC. (US) 2024-01-25 WO disclosed
WO-2024020517-A1 3-(6-PYRIDIN-3-YL)-2-[4-(4-METHYL-4H-1,2,4-TRIAZOL-3-YL)PIPERIDIN-1-YL]BENZONITRILE DERIVATIVES AND SIMILAR COMPOUNDS AS QPCTL AND QPCT INHIBITORS FOR THE TREATMENT OF CANCER 858 THERAPEUTICS, INC. (US) 2024-01-25 WO disclosed
WO-2022229234-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-11-03 WO disclosed
EP-3126350-B1 ISOINDOLINONE COMPOUNDS AS GPR119 MODULATORS FOR THE TREATMENT OF DIABETES, OBESITY, DYSLIPIDEMIA AND RELATED DISORDERS SANOFI SA (FR) 2018-07-04 EP disclosed
US-9908868-B2 Isoindolinone compounds as GPR119 modulators for the treatment of diabetes, obesity, dyslipidemia and related disorders SANOFI (FR) 2018-03-06 US disclosed
WO-2017046318-A1 TRIAZOLONES DERIVATIVES FOR USE IN THE TREATMENT, AMELIORATION OR PREVENTION OF A VIRAL DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2017-03-23 WO disclosed
US-20170081323-A1 Triazolones derivatives for use in the treatment, amelioration or prevention of a viral disease HOFFMANN LA ROCHE (CH) 2017-03-23 US disclosed
US-20170022182-A1 ISOINDOLINONE COMPOUNDS AS GPR119 MODULATORS FOR THE TREATMENT OF DIABETES, OBESITY, DYSLIPIDEMIA AND RELATED DISORDERS SANOFI (FR) 2017-01-26 US disclosed
CN-106164068-A Isoindolinone compounds as the GPR119 regulator for the treatment of diabetes, obesity, dyslipidemia and associated conditions 赛诺菲 2016-11-23 CN 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-20170022182-A1 ISOINDOLINONE COMPOUNDS AS GPR119 MODULATORS FOR THE TREATMENT OF DIABETES, OBESITY, DYSLIPIDEMIA AND RELATED DISORDERS GPR119, GPR65, GPR88 CHEK1 4710/4885PIM1 3889/4885FLT3 3880/4885
US-20240101544-A1 INHIBITORS OF QPCTL AND QPCT ACAT1, ACAT2, LCAT CHEK1 2073/4885PIM1 3232/4885FLT3 2859/4885
US-20170081323-A1 Triazolones derivatives for use in the treatment, amelioration or prevention of a viral disease OAT, XDH, MAPT CHEK1 1722/4885PIM1 4523/4885FLT3 1244/4885
US-20240246983-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES NES, NUDC, NCL CHEK1 3459/4885PIM1 1675/4885FLT3 1645/4885

“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.