SCHEMBL21030746

SCHEMBL21030746

Cc1ncn(-c2ccc(C(C)C)cc2C#N)n1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.36
SCN5A Q14524 1/20 0.35
SCN9A Q15858 1/20 0.35
ALDH1A1 P00352 2/20 0.35
NPC1 O15118 1/20 0.35
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
P2RX3 P56373 3/20 0.32
P2RX2 Q9UBL9 3/20 0.32
CRHR1 P34998 2/20 0.32
KDM4E B2RXH2 2/20 0.32
EGFR P00533 1/20 0.31
ERBB2 P04626 1/20 0.31

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
SCHEMBL18773501 0.82 ALOX5AP (0.39) ALOX5APALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL964746 0.80 KDM4E (0.49) ALOX5APALDH1A1NPC1HPGDRAB9A
SCHEMBL20085553 0.78 PSEN1 (0.35) CRHR1
SCHEMBL21030429 0.78 MALT1 (0.34) CRHR1
SCHEMBL20085563 0.78 TRPA1 (0.46) ALDH1A1HPGDRAB9ASMN1; SMN2CRHR1
SCHEMBL14321145 0.77 ALOX5AP (0.36) ALOX5APALDH1A1HPGDKDM4EEGFR
SCHEMBL14321124 0.77 ALOX5AP (0.36) ALOX5APKDM4E
SCHEMBL4832417 0.76 KDM4E (0.50) ALOX5APSMN1; SMN2KDM4E
SCHEMBL20085552 0.76 CRHR1 (0.33) ALDH1A1CRHR1
SCHEMBL6124230 0.76 ALDH1A1 (0.41) ALDH1A1CRHR1

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-20210052556-A1 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS LUPIN LTD (IN) 2021-02-25 US disclosed
US-20190275012-A9 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS LUPIN LIMITED (IN) 2019-09-12 US disclosed
US-20190160045-A1 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS LUPIN LTD (IN) 2019-05-30 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-20210052556-A1 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS MALT1, PTP4A1, PTPRO ALOX5AP 2828/4885SCN5A 2936/4885SCN9A 4071/4885
US-20190275012-A9 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS MALT1, PTP4A1, PTPRO ALOX5AP 2828/4885SCN5A 2936/4885SCN9A 4071/4885
US-20190160045-A1 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS MALT1, PTP4A1, PTPRO ALOX5AP 2828/4885SCN5A 2936/4885SCN9A 4071/4885

“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.