SCHEMBL30007925

SCHEMBL30007925

CCCCC(=O)Nc1cnc(Cl)cn1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.61
MAPK1 P28482 2/20 0.61
NPC1 O15118 1/20 0.61
GLA P06280 1/20 0.61
SMN1; SMN2 Q16637 3/20 0.60
RAB9A P51151 4/20 0.58
DEGS1 O15121 1/20 0.54
MAPT P10636 1/20 0.50
MAPK10 P53779 1/20 0.48
ALDH1A1 P00352 2/20 0.47
POLB P06746 1/20 0.44
HPGD P15428 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL30008156 0.81 RAB9A (0.67) L3MBTL1MAPK1NPC1GLASMN1; SMN2
SCHEMBL14788895 0.81 TSHR (0.56) L3MBTL1MAPK1NPC1GLARAB9A
SCHEMBL24843516 0.80 NPC1 (0.47) L3MBTL1MAPK1NPC1GLASMN1; SMN2
SCHEMBL15527734 0.80 L3MBTL1 (0.51) L3MBTL1MAPK1NPC1GLASMN1; SMN2
SCHEMBL30008478 0.80 L3MBTL1 (0.91) L3MBTL1MAPK1NPC1GLASMN1; SMN2
SCHEMBL29791335 0.79 L3MBTL1 (0.51) L3MBTL1MAPK1NPC1GLASMN1; SMN2
SCHEMBL1848793 0.78 L3MBTL1 (0.61) L3MBTL1MAPK1NPC1GLASMN1; SMN2
SCHEMBL27902865 0.77 TDP1 (0.45) L3MBTL1MAPK1NPC1GLARAB9A
SCHEMBL1849856 0.75 SMN1; SMN2 (0.73) L3MBTL1MAPK1NPC1GLASMN1; SMN2
SCHEMBL28838814 0.75 L3MBTL1 (0.64) L3MBTL1MAPK1NPC1GLASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220402875-A1 S1P3 Antagonists TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2022-12-22 US disclosed
US-11472772-B2 S1P3 antagonists TEVA PHARMACEUTICAL INDUSTRIES LIMITED (IL) 2022-10-18 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 (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-20220402875-A1 S1P3 Antagonists S1PR3, S1PR5, S1PR1 L3MBTL1 4523/4885MAPK1 2589/4885NPC1 292/4885
US-11472772-B2 S1P3 antagonists S1PR3, S1PR5, S1PR1 L3MBTL1 4523/4885MAPK1 2589/4885NPC1 292/4885

“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.