SCHEMBL3200151

SCHEMBL3200151

O=C(NC1CC1)c1ccc(Cl)c(-c2ccc(-c3ccccc3)cc2)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.68
MEN1 O00255 2/20 0.68
KMT2A Q03164 2/20 0.68
RAB9A P51151 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
MAPK14 Q16539 8/20 0.68
SMYD3 Q9H7B4 2/20 0.60
CYP46A1 Q9Y6A2 1/20 0.56
RIPK2 O43353 2/20 0.54
MAPK13 O15264 1/20 0.49
HSPB1 P04792 1/20 0.49
CYP2C9 P11712 1/20 0.49
MAPK11 Q15759 1/20 0.49
LCK P06239 1/20 0.48
KIT P10721 1/20 0.48
KDR P35968 1/20 0.48
KDM4E B2RXH2 1/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
MAPK1 P28482 1/20 0.48

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
SCHEMBL3211244 0.95 MAPK14 (0.62) NPC1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL3222814 0.91 MAPK14 (0.58) NPC1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL3218291 0.89 MAPK14 (0.56) NPC1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL2979351 0.82 RAB9A (1.00) NPC1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL3217850 0.82 USP30 (0.58) NPC1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL5631549 0.81 MAPK14 (1.00) MAPK14HSPB1CYP2C9MAPK11
SCHEMBL3205630 0.81 TSHR (0.55) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL31367847 0.81 MAPK14 (0.74) NPC1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL3218355 0.81 MAPK14 (0.74) MEN1KMT2AMAPK14HSPB1CYP2C9
SCHEMBL3224598 0.80 ALDH1A1 (0.51) MEN1KMT2ARAB9ASMN1; SMN2MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7683097-B2 Topoisomerase inhibitors Propharmacon Inc. (US) 2010-03-23 US claimed
US-7683097-B2 Topoisomerase inhibitors Propharmacon Inc. (US) 2010-03-23 US disclosed
US-20070004701-A1 Topoisomerase inhibitors PROPHARMACON, INC. (US) 2007-01-04 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-20070004701-A1 Topoisomerase inhibitors TOP1, TOP2A, TOP2B NPC1 2916/4885MEN1 2335/4885KMT2A 764/4885

“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.