SCHEMBL9906756

SCHEMBL9906756

O=C(N(c1ccccc1)c1ccccc1)n1cccc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.57
LMNA P02545 1/20 0.57
THRB P10828 1/20 0.57
HPGD P15428 1/20 0.57
NPSR1 Q6W5P4 2/20 0.54
ALDH1A1 P00352 6/20 0.47
POLB P06746 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TSHR P16473 1/20 0.46
KMT2A Q03164 2/20 0.45
NPC1 O15118 1/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 1/20 0.45
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
AGTR2 P50052 1/20 0.44
TRPM8 Q7Z2W7 1/20 0.41
TACR1 P25103 1/20 0.41

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
SCHEMBL5820950 0.81 NPSR1 (0.41) L3MBTL1LMNATHRBHPGDNPSR1
SCHEMBL467007 0.77 LMNA (0.53) L3MBTL1LMNATHRBHPGDNPSR1
SCHEMBL7467929 0.74 ALDH1A1 (0.77) L3MBTL1NPSR1ALDH1A1POLBSMN1; SMN2
SCHEMBL11195264 0.71 ALDH1A1 (0.83) L3MBTL1HPGDNPSR1ALDH1A1POLB
SCHEMBL24937727 0.71 NPSR1 (0.50) L3MBTL1LMNATHRBHPGDNPSR1
SCHEMBL19778 0.71 NPSR1 (0.70) L3MBTL1HPGDNPSR1ALDH1A1POLB
SCHEMBL812818 0.71 NPSR1 (1.00) L3MBTL1HPGDNPSR1ALDH1A1POLB
SCHEMBL28394067 0.70 TSHR (0.57) L3MBTL1LMNATHRBHPGDNPSR1
SCHEMBL9546821 0.70 L3MBTL1 (0.45) L3MBTL1LMNATHRBHPGDNPSR1
SCHEMBL11661567 0.69 ALDH1A1 (0.87) L3MBTL1HPGDNPSR1ALDH1A1POLB

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-8198487-B2 Method for lithium exchange reactions LONZA AG (CH) 2012-06-12 US disclosed
US-20100113839-A1 METHOD FOR LITHIUM EXCHANGE REACTIONS LONZA AG (CH) 2010-05-06 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-20100113839-A1 METHOD FOR LITHIUM EXCHANGE REACTIONS SLC6A5, SLC6A9, SLC6A6 L3MBTL1 2788/4885LMNA 1170/4885THRB 3707/4885

“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.