SCHEMBL25015342

SCHEMBL25015342

CC(=O)N1Cc2ccccc2-c2c(nnn2I)-c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 6/20 0.47
HSD17B3 P37058 13/20 0.46
KDM4E B2RXH2 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL15948103 0.95 HSD17B3 (0.49) NOTUMHSD17B3KDM4EHTTSMN1; SMN2
SCHEMBL21602832 0.88 HTT (0.49) NOTUMHSD17B3KDM4EHTTSMN1; SMN2
SCHEMBL25963258 0.88 NOTUM (0.35) NOTUMHSD17B3KDM4EHTTSMN1; SMN2
SCHEMBL16204540 0.86 NOTUM (0.48) NOTUMHSD17B3KDM4EHTTSMN1; SMN2
SCHEMBL24349696 0.84 NOTUM (0.46) NOTUMHSD17B3
SCHEMBL23027271 0.83 NOTUM (0.45) NOTUMHSD17B3KDM4EHTTSMN1; SMN2
SCHEMBL17469576 0.82 NOTUM (0.44) NOTUMHSD17B3KDM4EHTTSMN1; SMN2
SCHEMBL20202223 0.82 NPC1 (0.31) KDM4ESMN1; SMN2
SCHEMBL18737400 0.81 KDM4E (0.32) KDM4ESMN1; SMN2
SCHEMBL14887434 0.81 HSD17B3 (0.50) NOTUMHSD17B3KDM4EHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024146920-A1 DRUG CONJUGATES FOR THE TREATMENT OF OCULAR DISORDERS ASCENDIS PHARMA OPHTHALMOLOGY DIVISION A/S (DK) 2024-07-11 WO disclosed
WO-2024146902-A1 METHODS OF PRODUCING HYDROGEL MICROSPHERES ASCENDIS PHARMA A/S (DK) 2024-07-11 WO disclosed
WO-2023141856-A1 CD3-TARGETING MULTISPECIFIC ANTIBODY AND USE THEREOF 岩唐生物科技(杭州)有限责任公司 2023-08-03 WO disclosed
WO-2023065137-A1 SITE-SPECIFIC GLYCOPROTEIN CONJUGATES AND METHODS FOR MAKING THE SAME GLYCO-THERAPY BIOTECHNOLOGY CO., LTD. (CN) 2023-04-27 WO disclosed
WO-2023014988-A1 CONJUGATES COMPRISING COVALENT BINDERS FOR TARGETING INTRACELLULAR PROTEINS RAYZEBIO, INC. (US) 2023-02-09 WO disclosed