SCHEMBL21144153

SCHEMBL21144153

Cc1csc(-c2nc(O)cc(C(C)(C)C)n2)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.36
ADORA2A P29274 7/20 0.36
PDE10A Q9Y233 1/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
HCRTR1 O43613 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 0.35
S100A4 P26447 1/20 0.35
CYP2E1 P05181 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2A6 P11509 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2B6 P20813 1/20 0.34
CYP19A1 P11511 1/20 0.34

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
SCHEMBL2118672 0.84 MIF (0.42) MIFADORA2APDE10ARAB9ASMN1; SMN2
SCHEMBL21144386 0.83 ADORA2A (0.36) ADORA2APDE10ARAB9ASMN1; SMN2NPC1
SCHEMBL19691023 0.81 MIF (0.40) MIFADORA2APDE10ARAB9ASMN1; SMN2
SCHEMBL21144367 0.75 PDE10A (0.43) MIFADORA2APDE10ARAB9ASMN1; SMN2
SCHEMBL21144064 0.74 ADORA2A (0.38) MIFADORA2APDE10ARAB9ASMN1; SMN2
SCHEMBL577698 0.74 PDE10A (0.39) MIFADORA2APDE10ALMNAHPGD
SCHEMBL21143774 0.70 PDE10A (0.40) MIFADORA2APDE10ARAB9ASMN1; SMN2
SCHEMBL21143839 0.70 ADORA2A (0.40) MIFADORA2APDE10ARAB9ASMN1; SMN2
Ammonia Solution, Strong SCHEMBL27537691 0.69 PDE10A (0.39) MIFADORA2APDE10ARAB9ASMN1; SMN2
SCHEMBL2719104 0.69 HSD17B10 (0.34) SMN1; SMN2ALDH1A1ALOX15HSD17B10CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240317705-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2024-09-26 US disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 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 (3 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-20240317705-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 MIF 4849/4885ADORA2A 1711/4885PDE10A 484/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 MIF 4849/4885ADORA2A 1711/4885PDE10A 484/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 MIF 4849/4885ADORA2A 1711/4885PDE10A 484/4885

“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.