SCHEMBL21610231

SCHEMBL21610231

CCc1cc(Oc2cc(Br)ncn2)ccc1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ RAF1 P04049 6/20 0.36
▸ KMO O15229 1/20 0.35
▸ HAO1 Q9UJM8 2/20 0.34
▸ CASP3 P42574 1/20 0.34
▸ SENP8 Q96LD8 1/20 0.34
▸ SENP7 Q9BQF6 1/20 0.34
▸ SENP6 Q9GZR1 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ KDR P35968 2/20 0.34
▸ MAPK14 Q16539 1/20 0.34
▸ TNNI3K Q59H18 1/20 0.34
▸ MAP2K7 O14733 3/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ RAB9A P51151 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
SCHEMBL21610170 0.83 HAO1 (0.47) SMN1; SMN2L3MBTL1RAF1KMOHAO1
SCHEMBL21610146 0.82 ALDH1A1 (0.40) SMN1; SMN2L3MBTL1RAF1KMOHAO1
SCHEMBL21610256 0.79 MAP4K4 (0.40) SMN1; SMN2RAF1KMOHAO1CASP3
SCHEMBL21610144 0.79 RAF1 (0.39) SMN1; SMN2L3MBTL1RAF1KMOHAO1
SCHEMBL21610241 0.78 DRD1 (0.38) SMN1; SMN2RAF1HAO1CASP3SENP8
SCHEMBL21610188 0.77 SMN1; SMN2 (0.52) SMN1; SMN2L3MBTL1CASP3SENP8SENP7
SCHEMBL21610164 0.76 KDR (0.36) SMN1; SMN2RAF1HAO1CASP3SENP8
SCHEMBL28384106 0.76 HTR2A (0.39) SMN1; SMN2L3MBTL1MAPT
SCHEMBL21610229 0.75 RAF1 (0.39) SMN1; SMN2RAF1HAO1CASP3SENP8
SCHEMBL21610145 0.73 L3MBTL1 (0.49) SMN1; SMN2L3MBTL1RAF1HAO1CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3947365-B1 SUBSTITUTED-N-HETEROARYL COMPOUNDS AND USES THEREOF BIONOMICS LTD (AU) 2025-10-01 — — EP disclosed
US-12139473-B2 Substituted-N-heteroaryl compounds and uses thereof BIONOMICS LIMITED (AU) 2024-11-12 — — US disclosed
US-20220112176-A1 SUBSTITUTED-N-HETEROARYL COMPOUNDS AND USES THEREOF BIONOMICS LIMITED (AU) 2022-04-14 — — US disclosed
US-20220112176-A1 SUBSTITUTED-N-HETEROARYL COMPOUNDS AND USES THEREOF BIONOMICS LIMITED (AU) 2022-04-14 — — US disclosed
EP-3947365-A2 SUBSTITUTED-N-HETEROARYL COMPOUNDS AND USES THEREOF Bionomics Limited (AU) 2022-02-09 — — EP disclosed
WO-2020000065-A2 SUBSTITUTED-N-HETEROARYL COMPOUNDS AND USES THEREOF BIONOMICS LIMITED (AU) 2020-01-02 — — WO disclosed
WO-2020000065-A2 SUBSTITUTED-N-HETEROARYL COMPOUNDS AND USES THEREOF BIONOMICS LIMITED (AU) 2020-01-02 — — WO 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 (2 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-20220112176-A1 SUBSTITUTED-N-HETEROARYL COMPOUNDS AND USES THEREOF GABRE, GRIN2C, GRIN2A SMN1; SMN2 768/4885L3MBTL1 2809/4885RAF1 2349/4885
US-12139473-B2 Substituted-N-heteroaryl compounds and uses thereof SCN3A, KCND3, GRIN3A SMN1; SMN2 1749/4885L3MBTL1 2240/4885RAF1 1163/4885

“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.

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