SCHEMBL171635

SCHEMBL171635

N#Cc1ccc(I)cc1F

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 2/20 0.57
CYP11B2 P19099 18/20 0.44
CYP11B1 P15538 17/20 0.44

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
SCHEMBL19826456 0.86 CYP11B2 (0.48) TRPV4CYP11B2CYP11B1
SCHEMBL301704 0.82 TRPV4 (0.43) TRPV4CYP11B2CYP11B1
SCHEMBL769392 0.78 MAOB (0.42) TRPV4
SCHEMBL15540252 0.77 TRPV4 (0.33) TRPV4
SCHEMBL30919072 0.76 TRPV4 (0.61) TRPV4CYP11B2CYP11B1
SCHEMBL57346 0.76 TRPV4 (0.61) TRPV4CYP11B2CYP11B1
SCHEMBL18297999 0.76 CYP11B2 (0.67) TRPV4CYP11B2CYP11B1
SCHEMBL21687452 0.76 TRPV4 (0.35) TRPV4
SCHEMBL9612021 0.74 CYP11B2 (0.68) TRPV4CYP11B2CYP11B1
SCHEMBL1797379 0.74 TRPV4 (0.59) TRPV4CYP11B2CYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111511725-B 1-cyano-2- (4-cyclopropyl-benzyl) -4-) (beta-D-glucopyranos-1-yl) -benzene Synthesis of 1:1:1 Co-crystals of L-proline and Water 勃林格殷格翰维特梅迪卡有限公司 2024-04-09 CN claimed
US-11225500-B2 Synthesis of 1:1:1 co-crystal of 1-cyano-2-(4-cyclopropyl-benzyl)-4-(β-D-glucopyranos-1-yl)-benzene, L-proline and water BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2022-01-18 US claimed
US-20210139520-A1 SYNTHESIS OF 1:1:1 CO-CRYSTAL OF 1-CYANO-2-(4-CYCLOPROPYL-BENZYL)-4-(ß-D-GLUCOPYRANOS-1-YL)-BENZENE, L-PROLINE AND WATER BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2021-05-13 US claimed
CN-111511725-A Synthesis of 1:1:1 cocrystals of 1-cyano-2- (4-cyclopropyl-benzyl) -4- (β -D-glucopyranos-1-yl) -benzene, L-proline and water 勃林格殷格翰维特梅迪卡有限公司 2020-08-07 CN claimed
EP-3668846-A1 SYNTHESIS OF THE 1 :1 :1 CO-CRYSTAL OF 1 -CYANO-2-(4-CYCLOPROPYL-BENZYL)-4-(BETA-D-GLUCOPYRANOS-1 -YL)-BENZENE, L-PROLINE AND WATER Boehringer Ingelheim Vetmedica GmbH (DE) 2020-06-24 EP claimed
JP-4128258-A None JP disclosed
WO-2025262297-A1 PROTAC DEGRADERS OF MLLT1 AND/OR MLLT3 DARK BLUE THERAPEUTICS LTD (GB) 2025-12-26 WO disclosed
US-20250221979-A1 NOVEL HETEROCYCLIC COMPOUND SHOUYAO HOLDINGS BEIJING CO LTD (CN) 2025-07-10 US disclosed
CN-119661371-A Preparation method of 2-fluoro-4-methylaniline 帕潘纳(北京)科技有限公司 2025-03-21 CN disclosed
US-20250092016-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CORONAVIRAL RELATED DISEASES NOVARTIS AG (CH) 2025-03-20 US disclosed
EP-4501912-A1 NOVEL HETEROCYCLIC COMPOUND Shouyao Holdings (Beijing) Co., Ltd. (CN) 2025-02-05 EP disclosed
CN-118475560-A Novel heterocyclic compound 首药控股(北京)股份有限公司 2024-08-09 CN disclosed
CN-101360713-A 6- (polysubstituted aryl) -4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2009-02-04 CN disclosed
US-20090023702-A1 PYRIDONE GPR119 G PROTEIN-COUPLED RECEPTOR AGONISTS BRISTOL-MYERS SQUIBB COMPANY 2009-01-22 US disclosed
WO-2009012275-A1 PYRIDONE GPR119 G PROTEIN-COUPLED RECEPTOR AGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-22 WO disclosed
CN-101326184-A Bis-heterocyclic imidazolyl compounds SPEEDEL EXPERIMENTA AG (CH) 2008-12-17 CN disclosed
EP-0442266-B1 Tolan derivatives, liquid crystal compositions containing them, and liquid crystal elements using them SEIKO EPSON CORP (JP) 1994-12-28 EP disclosed
US-5314640-A Tolan derivatives, liquid crystal compositions including same, liquid crystal display devices including the compositions and method of preparation SEIKO EPSON CORPORATION (JP) 1994-05-24 US disclosed
JP-H04128258-A TOLAN DERIVATIVE, LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME DERIVATIVE AND LIQUID CRYSTAL ELEMENT USING THE SAME COMPOSITION SEIKO EPSON CORP 1992-04-28 JP disclosed
EP-0442266-A1 Tolan derivatives, liquid crystal compositions containing them, and liquid crystal elements using them SEIKO EPSON CORPORATION (JP) 1991-08-21 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-11225500-B2 Synthesis of 1:1:1 co-crystal of 1-cyano-2-(4-cyclopropyl-benzyl)-4-(β-D-glucopyranos-1-yl)-benzene, L-proline and water COL1A1, DCXR, PLOD1 TRPV4 3767/4885CYP11B2 2222/4885CYP11B1 1294/4885
US-20210139520-A1 SYNTHESIS OF 1:1:1 CO-CRYSTAL OF 1-CYANO-2-(4-CYCLOPROPYL-BENZYL)-4-(ß-D-GLUCOPYRANOS-1-YL)-BENZENE, L-PROLINE AND WATER COL1A1, DCXR, PLOD1 TRPV4 3741/4885CYP11B2 2219/4885CYP11B1 1289/4885
US-20250092016-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CORONAVIRAL RELATED DISEASES ACE2, ACE, TMPRSS2 TRPV4 4257/4885CYP11B2 600/4885CYP11B1 1153/4885
US-20250221979-A1 NOVEL HETEROCYCLIC COMPOUND MAPT, MNAT1, MAT2A TRPV4 2728/4885CYP11B2 9/4885CYP11B1 48/4885
US-20090023702-A1 PYRIDONE GPR119 G PROTEIN-COUPLED RECEPTOR AGONISTS GPR119, GPR65, GPR27 TRPV4 506/4885CYP11B2 1057/4885CYP11B1 889/4885

“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.