SCHEMBL26847644

SCHEMBL26847644

Cc1cc(-c2ccc(Cl)o2)nn1C

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ PTGS1 P23219 3/20 0.35
▸ APOBEC3G Q9HC16 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ PTGS2 P35354 1/20 0.33
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ LMNA P02545 1/20 0.31
▸ BAZ2B Q9UIF8 1/20 0.31
▸ PDE4B Q07343 1/20 0.31
▸ PDE4D Q08499 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL26847491 0.71 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2CYP1A2CYP3A4APOBEC3G
SCHEMBL12090641 0.70 PTGS2 (0.51) ALDH1A1SMN1; SMN2PTGS1TDP1PTGS2
SCHEMBL21233174 0.70 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2CYP1A2CYP3A4APOBEC3G
SCHEMBL14091695 0.69 NPC1 (0.54) ALDH1A1SMN1; SMN2POLBMAPTHPGD
SCHEMBL26847544 0.67 CHRNA1 (0.36) ALDH1A1SMN1; SMN2CYP1A2CYP3A4TDP1
SCHEMBL21233177 0.67 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2CYP1A2CYP3A4APOBEC3G
SCHEMBL21233330 0.67 LMNA (0.42) ALDH1A1SMN1; SMN2CYP1A2CYP3A4APOBEC3G
SCHEMBL14996583 0.67 HSD11B1 (0.50) ALDH1A1SMN1; SMN2CYP1A2MAPTHPGD
SCHEMBL26847441 0.66 DRD2 (0.36) ALDH1A1SMN1; SMN2CYP1A2CYP3A4POLB
SCHEMBL14996550 0.66 HSD11B1 (0.54) ALDH1A1HPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365571-A1 COMPOUNDS AND COMPOSITIONS AS Sppl2a INHIBITORS NOVARTIS AG (CH) 2023-11-16 — — US disclosed
US-20230365571-A1 COMPOUNDS AND COMPOSITIONS AS Sppl2a INHIBITORS NOVARTIS AG (CH) 2023-11-16 — — US 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 (1 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-20230365571-A1 COMPOUNDS AND COMPOSITIONS AS Sppl2a INHIBITORS SPPL2A, SPPL2B, BACE1 RORC 3545/4885ALDH1A1 3565/4885SMN1; SMN2 2626/4885

“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.

Send feedback