SCHEMBL28218477

SCHEMBL28218477

CC(C)CC(NC(=O)c1cc2ccccc2s1)C(=O)N1CCN(C(=O)C(CO)NS(=O)(=O)c2ccc(Cl)cc2Cl)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 2/20 1.00
TAS1R3 Q7RTX0 2/20 0.49
TAS1R1 Q7RTX1 2/20 0.49
CCR1 P32246 4/20 0.47
CTSK P43235 5/20 0.43
CTSB P07858 1/20 0.41
CTSS P25774 1/20 0.41
PIN1 Q13526 1/20 0.41
ACKR3 P25106 1/20 0.40
UTS2R Q9UKP6 2/20 0.39
MC4R P32245 1/20 0.39

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
SCHEMBL29353598 1.00 TRPV4 (1.00) TRPV4TAS1R3TAS1R1CCR1CTSK
SCHEMBL5004499 1.00 TRPV4 (1.00) TRPV4TAS1R3TAS1R1CCR1CTSK
SCHEMBL5007988 1.00 TRPV4 (1.00) TRPV4TAS1R3TAS1R1CCR1CTSK
SCHEMBL4971055 0.97 TRPV4 (0.94) TRPV4TAS1R3TAS1R1CCR1CTSK
SCHEMBL5007170 0.94 TRPV4 (0.89) TRPV4TAS1R3TAS1R1CCR1CTSK
SCHEMBL5004275 0.93 TRPV4 (0.87) TRPV4TAS1R3TAS1R1CCR1CTSK
SCHEMBL5007926 0.92 TRPV4 (0.85) TRPV4TAS1R3TAS1R1CCR1CTSK
SCHEMBL5007997 0.91 TRPV4 (0.84) TRPV4TAS1R3TAS1R1CCR1CTSK
SCHEMBL4993946 0.91 TRPV4 (0.84) TRPV4TAS1R3TAS1R1CCR1CTSK
SCHEMBL5007250 0.91 TRPV4 (0.83) TRPV4TAS1R3TAS1R1CCR1CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250179425-A1 Single Cell Encapsulation in Compartmentalized Hydrogel Coatings THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2025-06-05 US disclosed
CN-115317488-B Application of GSK1016790A in preparation of medicine for treating or relieving diabetic enteropathy 南华大学附属第一医院 2024-04-23 CN disclosed
CN-114569614-B Application of TRPV4 agonist in preparation of medicines for treating and/or preventing male infertility 南华大学 2023-07-21 CN disclosed
CN-115317488-A Application of GSK1016790A in preparing medicine for treating or relieving diabetic enteropathy 南华大学附属第一医院 2022-11-11 CN disclosed
CN-113082032-B Novel application of TRPV4 agonist 中山大学 2022-08-12 CN disclosed
CN-114569614-A Application of TRPV4 agonist in preparation of medicines for treating and/or preventing male infertility 南华大学 2022-06-03 CN disclosed
CN-113082032-A Novel application of TRPV4 agonist 中山大学 2021-07-09 CN disclosed
CN-111195253-A Novel application of TRPV4 agonist GSK1016790A 南华大学 2020-05-26 CN disclosed
CN-108186647-B Medical application of compound 中南大学湘雅二医院 2020-04-07 CN disclosed
CN-105524034-B Preparation, pharmacological action and the application for treating cerebral ischemia of coumarin derivative 北京大学 2018-08-17 CN disclosed
CN-105566269-B Preparation, pharmacological action and the application for treating itch of coumarin derivative 北京大学 2018-07-10 CN disclosed