SCHEMBL29948137

SCHEMBL29948137

COc1c(C(N)=O)ccc2c1nc(-c1c(F)cccc1-c1n[nH]c(=O)o1)n2CCn1c(-c2c(F)cccc2-c2n[nH]c(=O)o2)nc2c(OC)c(C(N)=O)ccc21

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 7/20 0.40
PARP1 P09874 2/20 0.37
PKN1 Q16512 1/20 0.36
PKN2 Q16513 1/20 0.36
CHRM2 P08172 4/20 0.34
CHRM1 P11229 4/20 0.34
RRM1 P23921 4/20 0.34
RRM2B Q7LG56 4/20 0.34
IL2 P60568 1/20 0.34
PTGER4 P35408 2/20 0.34
TYK2 P29597 1/20 0.34
CTSD P07339 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GLA P06280 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL23529308 1.00 NOTUM (0.40) NOTUMPARP1PKN1PKN2CHRM2
SCHEMBL23529337 0.89 PTGER4 (0.33) NOTUMPARP1PKN1PKN2CHRM2
SCHEMBL29948206 0.89 PTGER4 (0.33) NOTUMPARP1PKN1PKN2CHRM2
SCHEMBL29948192 0.89 RRM1 (0.36) NOTUMCHRM2CHRM1RRM1RRM2B
SCHEMBL23529326 0.89 RRM1 (0.36) NOTUMCHRM2CHRM1RRM1RRM2B
SCHEMBL24800770 0.83 POLQ (0.37) PARP1PKN1PKN2PTGER4TYK2
SCHEMBL30159523 0.83 POLQ (0.37) PARP1PKN1PKN2PTGER4TYK2
SCHEMBL24801182 0.82 TYK2 (0.38) PARP1PKN1PKN2PTGER4TYK2
SCHEMBL30159588 0.82 TYK2 (0.38) PARP1PKN1PKN2PTGER4TYK2
SCHEMBL23529304 0.81 ACSS2 (0.39) PARP1PKN1PKN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4077318-B1 BENZIMIDAZOLE DIMERS AS MODULATORS OF STING CTXT PTY LTD (AU) 2025-10-15 EP claimed
CN-114981265-B Compounds of formula (I) CTXT私人有限公司 2025-01-03 CN claimed
EP-4077318-A1 COMPOUNDS CTXT PTY LTD (AU) 2022-10-26 EP claimed
CN-114981265-B Compounds of formula (I) CTXT私人有限公司 2025-01-03 CN disclosed
WO-2022266711-A1 SUBSTITUTED AMIDOBENZIMIDAZOLE DIMERS AS STING MODULATORS Aculeus Therapeutics Pty Ltd (AU) 2022-12-29 WO disclosed
EP-4077318-A1 COMPOUNDS CTXT PTY LTD (AU) 2022-10-26 EP disclosed