SCHEMBL31336627

SCHEMBL31336627

Cn1cc(Cl)c(C(=O)OC(C)(C)C)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
MAPT P10636 1/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
MEN1 O00255 1/20 0.47
LMNA P02545 2/20 0.47
TSHR P16473 1/20 0.47
GLA P06280 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
POLB P06746 1/20 0.44
RAB9A P51151 5/20 0.44
NPC1 O15118 3/20 0.44
HSD17B10 Q99714 1/20 0.43
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
KDM4E B2RXH2 5/20 0.40
GAA P10253 3/20 0.40
ALPL P05186 2/20 0.40

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
SCHEMBL19256695 0.83 CYP2C9 (0.38) KMT2AMAPTCASP3SENP8SENP7
SCHEMBL31336757 0.81 ALDH1A1 (0.45) KMT2AMAPTMEN1LMNASMN1; SMN2
SCHEMBL19207048 0.81 HTR2A (0.37) KMT2AMAPTCASP3SENP8SENP7
SCHEMBL985062 0.80 KMT2A (0.59) KMT2AMAPTCASP3SENP8SENP7
SCHEMBL19207086 0.80 GABRA1 (0.35) KMT2AMAPTCASP3SENP8SENP7
SCHEMBL19098788 0.77 LMNA (0.54) KMT2AMAPTCASP3SENP8SENP7
SCHEMBL982676 0.76 KMT2A (0.57) KMT2AMAPTCASP3SENP8SENP7
SCHEMBL982875 0.76 LMNA (0.53) KMT2AMAPTCASP3SENP8SENP7
SCHEMBL13836303 0.76 LMNA (0.53) KMT2AMAPTCASP3SENP8SENP7
SCHEMBL2582284 0.74 LMNA (0.51) KMT2AMAPTCASP3SENP8SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4688154-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS BIAL - Portela & Ca., S.A. (PT) 2026-02-11 EP disclosed
EP-4688155-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS Bial-Portela & CA, S.A. (PT) 2026-02-11 EP disclosed
WO-2025023852-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS BIAL - PORTELA & CA., S.A. (PT) 2025-01-30 WO disclosed
WO-2025023851-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS BIAL - PORTELA & CA., S.A. (PT) 2025-01-30 WO disclosed