SCHEMBL22904396

SCHEMBL22904396

C=C(C)Nc1nc(C)cs1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.56
RAB9A P51151 12/20 0.53
NPC1 O15118 10/20 0.53
POLB P06746 2/20 0.53
SMN1; SMN2 Q16637 5/20 0.49
HPGD P15428 4/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 2/20 0.47
GAA P10253 2/20 0.47
ALDH1A1 P00352 2/20 0.47
TP53 P04637 1/20 0.47
HTT P42858 1/20 0.47
HSD17B10 Q99714 1/20 0.47
RCE1 Q9Y256 1/20 0.47
PKM P14618 1/20 0.46
CNR2 P34972 1/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46

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
SCHEMBL48394 0.80 MAPT (0.66) MAPTRAB9ANPC1POLBSMN1; SMN2
SCHEMBL19994395 0.80 MAPT (0.66) MAPTRAB9ANPC1POLBSMN1; SMN2
SCHEMBL5630056 0.78 MAPT (0.64) MAPTRAB9ANPC1POLBSMN1; SMN2
SCHEMBL1691061 0.78 MAPT (0.68) MAPTRAB9ANPC1POLBSMN1; SMN2
SCHEMBL10816647 0.78 RAB9A (0.71) MAPTRAB9ANPC1POLBSMN1; SMN2
SCHEMBL23774148 0.77 MAPT (0.49) MAPTRAB9ANPC1POLBSMN1; SMN2
SCHEMBL3699546 0.74 MAPT (0.64) MAPTRAB9ANPC1POLBSMN1; SMN2
SCHEMBL6838461 0.74 MAPT (0.54) MAPTRAB9ANPC1POLBSMN1; SMN2
SCHEMBL2631600 0.74 MAPT (0.64) MAPTRAB9ANPC1POLBSMN1; SMN2
SCHEMBL3871228 0.74 MAPT (0.54) MAPTRAB9ANPC1POLBSMN1; SMN2

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
EP-4001276-A1 AURORA KINASE INHIBITOR AND USE THEREOF Wigen Biomedicine Technology (Shanghai) Co., Ltd. (CN) 2022-05-25 EP disclosed
WO-2021008338-A1 AURORA KINASE INHIBITOR AND USE THEREOF 微境生物医药科技(上海)有限公司 2021-01-21 WO disclosed
US-20160331734-A1 SUBSTITUTED N-ARYL PYRIDINONES AUSPEX PHARMACEUTICALS, INC. 2016-11-17 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 (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-20160331734-A1 SUBSTITUTED N-ARYL PYRIDINONES COL1A1, COL2A1, COLGALT1 MAPT 3778/4885RAB9A 2769/4885NPC1 2112/4885

“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.