SCHEMBL20030116

SCHEMBL20030116

Clc1nc(Cl)c2oc3ccc(-c4ccc5oc6ccccc6c5c4)cc3c2n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
PIM1 P11309 3/20 0.44
CSNK2A2 P19784 3/20 0.44
CSNK2B P67870 3/20 0.44
PIM3 Q86V86 3/20 0.44
PIM2 Q9P1W9 3/20 0.44
AHR P35869 3/20 0.43
KMT2A Q03164 6/20 0.41
ALDH1A1 P00352 5/20 0.41
LMNA P02545 5/20 0.41
GPR55 Q9Y2T6 1/20 0.41
CASP3 P42574 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
MEN1 O00255 5/20 0.40
MAPT P10636 5/20 0.40
HPGD P15428 3/20 0.40
KDM4E B2RXH2 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 1/20 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
SCHEMBL24388208 0.89 PIM1 (0.54) SMN1; SMN2PIM1CSNK2A2CSNK2BPIM3
SCHEMBL29565166 0.89 PIM1 (0.54) SMN1; SMN2PIM1CSNK2A2CSNK2BPIM3
SCHEMBL20659756 0.86 PIM1 (0.49) SMN1; SMN2PIM1CSNK2A2CSNK2BPIM3
SCHEMBL18688220 0.85 SMN1; SMN2 (0.54) SMN1; SMN2PIM1CSNK2A2CSNK2BPIM3
SCHEMBL1310612 0.84 SMN1; SMN2 (0.62) SMN1; SMN2PIM1CSNK2A2CSNK2BPIM3
SCHEMBL17297630 0.84 SMN1; SMN2 (0.46) SMN1; SMN2PIM1CSNK2A2CSNK2BPIM3
SCHEMBL24388426 0.82 PIM1 (0.43) SMN1; SMN2PIM1CSNK2A2CSNK2BPIM3
SCHEMBL24388410 0.80 PIM1 (0.47) SMN1; SMN2PIM1CSNK2A2CSNK2BPIM3
SCHEMBL20029892 0.80 PIM1 (0.40) SMN1; SMN2PIM1CSNK2A2CSNK2BPIM3
SCHEMBL23079609 0.78 AHR (0.51) SMN1; SMN2AHRKMT2AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12030890-B2 Compounds with diazadibenzofurane or diazadibenzothiophene structures MERCK PATENT GMBH (DE) 2024-07-09 US disclosed
US-12030890-B2 Compounds with diazadibenzofurane or diazadibenzothiophene structures MERCK PATENT GMBH (DE) 2024-07-09 US disclosed
US-20240215277-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2024-06-27 US disclosed
US-11530224-B2 Compounds with diazadibenzofurane or diazadibenzothiophene structures MERCK PATENT GMBH (DE) 2022-12-20 US disclosed
EP-3519417-B1 COMPOUNDS WITH DIAZADIBENZOFURANE OR DIAZADIBENZOTHIOPHENE STRUCTURES MERCK PATENT GMBH (DE) 2021-09-08 EP disclosed
WO-2018060307-A1 COMPOUNDS WITH DIAZADIBENZOFURANE OR DIAZADIBENZOTHIOPHENE STRUCTURES MERCK PATENT GMBH (DE) 2018-04-05 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-12030890-B2 Compounds with diazadibenzofurane or diazadibenzothiophene structures DDT, ESD, DBF4 SMN1; SMN2 4234/4885PIM1 344/4885CSNK2A2 4573/4885
US-11530224-B2 Compounds with diazadibenzofurane or diazadibenzothiophene structures DDT, ESD, DBF4 SMN1; SMN2 4234/4885PIM1 344/4885CSNK2A2 4573/4885

“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.