SCHEMBL25311738

SCHEMBL25311738

O=C(c1cccc(-c2nc3ccccc3[nH]2)n1)N1CC2CN(C(=O)c3cccc(-c4nc5ccccc5[nH]4)n3)CC2C1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LANCL2 Q9NS86 1/20 0.80
HRH4 Q9H3N8 3/20 0.55
RAB9A P51151 5/20 0.45
KDM4E B2RXH2 5/20 0.45
NPC1 O15118 4/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
HPGD P15428 4/20 0.45
ALDH1A1 P00352 4/20 0.45
PKM P14618 3/20 0.45
TP53 P04637 2/20 0.45
HSD17B10 Q99714 2/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
LMNA P02545 1/20 0.45
MTOR P42345 1/20 0.45
METAP2 P50579 1/20 0.45
METAP1 P53582 1/20 0.45
HTR2B P41595 1/20 0.45
PDE10A Q9Y233 5/20 0.44
KMT2A Q03164 2/20 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
SCHEMBL29466328 1.00 LANCL2 (0.80) LANCL2HRH4RAB9AKDM4ENPC1
SCHEMBL29063389 1.00 LANCL2 (0.80) LANCL2HRH4RAB9AKDM4ENPC1
SCHEMBL25314522 0.93 LANCL2 (0.70) LANCL2HRH4RAB9AKDM4ENPC1
SCHEMBL29466320 0.93 LANCL2 (0.73) LANCL2HRH4RAB9AKDM4ENPC1
SCHEMBL25313429 0.93 LANCL2 (0.73) LANCL2HRH4RAB9AKDM4ENPC1
Hydrochloric Acid SCHEMBL25311498 0.92 LANCL2 (0.71) LANCL2HRH4RAB9AKDM4ENPC1
Hydrochloric Acid SCHEMBL29466273 0.92 LANCL2 (0.71) LANCL2HRH4RAB9AKDM4ENPC1
SCHEMBL25312836 0.89 LANCL2 (0.64) LANCL2HRH4RAB9AKDM4ENPC1
SCHEMBL25262280 0.89 LANCL2 (0.64) LANCL2HRH4RAB9AKDM4ENPC1
Omilancor SCHEMBL17706588 0.89 LANCL2 (1.00) LANCL2HRH4RAB9AKDM4ENPC1

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-20240101552-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2024-03-28 US disclosed
EP-4215526-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF Shanghai Pharmaceuticals Holding Co., Ltd. (CN) 2023-07-26 EP disclosed
EP-4215526-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF Shanghai Pharmaceuticals Holding Co., Ltd. (CN) 2023-07-26 EP 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-20240101552-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF LANCL2, CBS, LCP2 LANCL2 1/4885HRH4 2379/4885RAB9A 2591/4885

“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.