SCHEMBL476854

SCHEMBL476854

Clc1cccc2[nH]ncc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 5/20 1.00
AXL P30530 2/20 0.59
IDO1 P14902 3/20 0.55
METAP2 P50579 2/20 0.53
JAK2 O60674 1/20 0.46
JAK1 P23458 1/20 0.46
HSP90AA1 P07900 1/20 0.45
CDK2 P24941 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2A6 P11509 1/20 0.44
TRPV1 Q8NER1 2/20 0.44
ABCB1 P08183 1/20 0.44
RARG P13631 1/20 0.43
TRPA1 O75762 1/20 0.42

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
SCHEMBL4314318 1.00 NOS1 (1.00) NOS1AXLIDO1METAP2JAK2
SCHEMBL30234107 1.00 NOS1 (1.00) NOS1AXLIDO1METAP2JAK2
SCHEMBL18669085 0.76 NOS1 (0.60) NOS1AXLIDO1JAK2JAK1
SCHEMBL12601112 0.76 NOS1 (0.61) NOS1AXLIDO1METAP2JAK2
SCHEMBL10594553 0.75 NOS1 (0.59) NOS1AXLIDO1METAP2TRPA1
SCHEMBL277054 0.74 NOS1 (0.59) NOS1AXLIDO1METAP2JAK2
SCHEMBL18193497 0.74 NOS1 (0.59) NOS1AXLIDO1METAP2JAK2
SCHEMBL277055 0.74 NOS1 (0.59) NOS1AXLIDO1METAP2JAK2
SCHEMBL155255 0.74 NOS1 (1.00) NOS1AXLIDO1METAP2JAK2
SCHEMBL5951586 0.74 AXL (0.63) NOS1AXLIDO1METAP2JAK2

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 350 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111995577-A Synthetic method of 4-fluoro indazole 3-carbonitrile or derivatives thereof 上海代为化学科技有限公司 2020-11-27 CN claimed
US-20250388599-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2025-12-25 US disclosed
US-20250353829-A1 BICYCLIC CARBOXAMIDES AND METHODS OF USE THEREOF TEMPEST THERAPEUTICS INC (US) 2025-11-20 US disclosed
US-20250333406-A1 SULFONYL CYCLIC DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF LYSOWAY THERAPEUTICS INC (US) 2025-10-30 US disclosed
US-20250304576-A1 IKK INHIBITORS CANCER RESEARCH TECH LTD (GB) 2025-10-02 US disclosed
EP-4522597-A1 IKK INHIBITORS Cancer Research Technology Limited (GB) 2025-03-19 EP disclosed
CN-119569700-A 6-Nitrogen-containing cyclopicolinic acid and partial formate compound thereof, and preparation method and application thereof 中国农业大学 2025-03-07 CN disclosed
CN-119562945-A IKK inhibitors 癌症研究技术有限公司 2025-03-04 CN disclosed
US-12215093-B2 Bicyclic carboxamides and methods of use thereof TEMPEST THERAPEUTICS, INC. (US) 2025-02-04 US disclosed
WO-2024220747-A2 FLUORINATED CYCLIC DERIVATIVES OF SULFONAMIDES AND SULFONES, AND COMPOSITIONS AND METHODS THEREOF Lysoway Therapeutics, Inc. (US) 2024-10-24 WO disclosed
WO-2000064889-A1 HERBICIDAL 3-(HETEROCYCL-1-YL)-URACILS AMERICAN CYANAMID COMPANY (US) 2000-11-02 WO disclosed
WO-2000064890-A1 HERBICIDAL 3-(HETEROCYCL-1-YL)-URACILS AMERICAN CYANAMID COMPANY (US) 2000-11-02 WO disclosed
US-6046136-A FOR CONTROLLING WEEDS ZENECA LIMITED (GB) 2000-04-04 US disclosed
US-5911899-A Corrosion-proof transparent heater panels and preparation process thereof MITSUI CHEMICALS, INC. (JP) 1999-06-15 US disclosed
EP-0657450-B1 INDAZOLESULFONYLUREA DERIVATIVE, USE THEREOF, AND INTERMEDIATE FOR PRODUCTION THEREOF KUMIAI CHEMICAL INDUSTRY CO (JP) 1998-09-09 EP disclosed
US-5763616-A HERBICIDES KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1998-06-09 US disclosed
US-5670452-A PREEMERGENCE HERBICIDES KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1997-09-23 US disclosed
EP-0749266-A2 Transparent heater panels and method of making them MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1996-12-18 EP disclosed
US-5534481-A Indazolesulfonylurea derivative, its use and intermediate for its production KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1996-07-09 US disclosed
EP-0657450-A1 INDAZOLESULFONYLUREA DERIVATIVE, USE THEREOF, AND INTERMEDIATE FOR PRODUCTION THEREOF KumaiI Chemical Industry Co., Ltd. (JP) 1995-06-14 EP 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 (5 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-20250304576-A1 IKK INHIBITORS NFKBIA, IKBKE, IKBKB NOS1 1221/4885AXL 1479/4885IDO1 1065/4885
US-20250353829-A1 BICYCLIC CARBOXAMIDES AND METHODS OF USE THEREOF PTGER4, PTGER2, CNR2 NOS1 3363/4885AXL 2869/4885IDO1 1260/4885
US-20250333406-A1 SULFONYL CYCLIC DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF STOML2, ATP2A3, ATP2A1 NOS1 4223/4885AXL 2312/4885IDO1 4856/4885
US-12215093-B2 Bicyclic carboxamides and methods of use thereof PTGER4, PTGER2, CNR2 NOS1 3363/4885AXL 2869/4885IDO1 1260/4885
US-20250388599-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE PIK3C2B, PIK3C2A, PIK3R1 NOS1 1992/4885AXL 613/4885IDO1 1546/4885

“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.