SCHEMBL3210146

SCHEMBL3210146

Cc1cc2nn(-c3ccc(Cl)cc3)nc2cc1NC(=O)C(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.74
SMN1; SMN2 Q16637 8/20 0.74
RAB9A P51151 8/20 0.74
KDM4E B2RXH2 7/20 0.74
ALDH1A1 P00352 6/20 0.74
HPGD P15428 3/20 0.74
HSD17B10 Q99714 3/20 0.74
MAPT P10636 4/20 0.64
THRB P10828 3/20 0.58
TP53 P04637 4/20 0.57
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
MITF O75030 1/20 0.56
PKM P14618 1/20 0.56
LMNA P02545 1/20 0.56
POLB P06746 1/20 0.55
GAA P10253 1/20 0.55
BACE1 P56817 1/20 0.55
ATM Q13315 1/20 0.52
CASP3 P42574 2/20 0.52

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
SCHEMBL27759222 0.86 NPC1 (0.76) NPC1SMN1; SMN2RAB9AKDM4EALDH1A1
SCHEMBL3220399 0.82 NPC1 (0.81) NPC1SMN1; SMN2RAB9AKDM4EALDH1A1
SCHEMBL3213720 0.82 SMN1; SMN2 (0.67) NPC1SMN1; SMN2RAB9AKDM4EALDH1A1
SCHEMBL3226706 0.81 NPC1 (0.79) NPC1SMN1; SMN2RAB9AKDM4EALDH1A1
SCHEMBL3224263 0.81 SMN1; SMN2 (0.67) NPC1SMN1; SMN2RAB9AKDM4EALDH1A1
SCHEMBL3229129 0.81 SMN1; SMN2 (0.78) NPC1SMN1; SMN2RAB9AKDM4EALDH1A1
SCHEMBL3226406 0.80 NPC1 (0.63) NPC1SMN1; SMN2RAB9AKDM4EALDH1A1
SCHEMBL24458166 0.80 MAPT (0.60) NPC1SMN1; SMN2RAB9AKDM4EALDH1A1
SCHEMBL24458167 0.80 MAPT (0.60) NPC1SMN1; SMN2RAB9AKDM4EALDH1A1
SCHEMBL3229062 0.79 SMN1; SMN2 (0.77) NPC1SMN1; SMN2RAB9AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100168072-A1 Drug Combinations for the Treatment of Duchenne Muscular Dystrophy BIOMARIN IGA LIMITED 2010-07-01 US claimed
US-20100168072-A1 Drug Combinations for the Treatment of Duchenne Muscular Dystrophy BIOMARIN IGA LIMITED 2010-07-01 US disclosed
EP-2170325-A2 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY Summit Corporation Plc (GB) 2010-04-07 EP disclosed
US-20100048660-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA LIMITED (BS) 2010-02-25 US disclosed
CN-101420952-A Treatment of duchenne muscular dystrophy SUMMIT CORP PLC (GB) 2009-04-29 CN disclosed
WO-2009019505-A2 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2009-02-12 WO disclosed
EP-1986643-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY Summit Corporation Plc (GB) 2008-11-05 EP disclosed
WO-2007091107-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2007-08-16 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-20100048660-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SMN1; SMN2, CPT1B, GYS1 NPC1 2950/4885SMN1; SMN2 1/4885RAB9A 1790/4885
US-20100168072-A1 Drug Combinations for the Treatment of Duchenne Muscular Dystrophy CPT1B, PYGM, MTPN NPC1 2697/4885SMN1; SMN2 5/4885RAB9A 3980/4885

“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.