SCHEMBL3780077

SCHEMBL3780077

CCOC(=O)c1nc(-c2cccnc2)c2snc(-c3ccccc3)c2c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 4/20 0.48
DBF4 Q9UBU7 4/20 0.48
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
ALDH1A1 P00352 5/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPT P10636 4/20 0.41
KDM4E B2RXH2 4/20 0.41
POLB P06746 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MAPK1 P28482 1/20 0.41
ATM Q13315 1/20 0.41
MMP2 P08253 1/20 0.41
MMP13 P45452 1/20 0.41

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
SCHEMBL3407905 0.91 CDC7 (0.53) CDC7DBF4NPC1RAB9AALDH1A1
SCHEMBL3401768 0.86 ALDH1A1 (0.49) CDC7DBF4NPC1RAB9AMEN1
SCHEMBL3401461 0.86 ALDH1A1 (0.51) CDC7DBF4NPC1RAB9AMEN1
SCHEMBL3405930 0.86 DHODH (0.48) MEN1KMT2AALDH1A1HSD17B10MAPT
SCHEMBL3407275 0.86 ALDH1A1 (0.51) CDC7DBF4NPC1RAB9AMEN1
SCHEMBL3405938 0.85 DHODH (0.49) CDC7DBF4MEN1KMT2AALDH1A1
SCHEMBL3407360 0.84 LMNA (0.44) CDC7DBF4NPC1RAB9AMEN1
SCHEMBL3398339 0.83 ALDH1A1 (0.44) CDC7DBF4NPC1RAB9AMEN1
SCHEMBL3403370 0.82 ALDH1A1 (0.46) CDC7DBF4NPC1RAB9AMEN1
SCHEMBL3788294 0.82 L3MBTL1 (0.47) CDC7DBF4NPC1RAB9AMEN1

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-9387200-B2 Isothiazole-pyridine derivatives as modulators of HIF (hypoxia inducible factor) activity FIBROGEN, INC. (US) 2016-07-12 US disclosed
US-20150209336-A1 ISOTHIAZOLE-PYRIDINE DERIVATIVES AS MODULATORS OF HIF (HYPOXIA INDUCIBLE FACTOR) ACTIVITY FIBROGEN, INC. 2015-07-30 US disclosed
US-8952160-B2 Isothiazole-pyridine derivatives as modulators of HIF (hypoxia inducible factor) activity FIBROGEN, INC. (US) 2015-02-10 US disclosed
EP-2252619-B1 ISOTHIAZOLE-PYRIDINE DERIVATIVES AS MODULATORS OF HIF (HYPOXIA INDUCIBLE FACTOR) ACTIVITY FIBROGEN INC (US) 2013-10-09 EP disclosed
US-20100330199-A1 ISOTHIAZOLE-PYRIDINE DERIVATES AS MODULATORS OF HIF (HYPOXIA INDUCIBLE FACTOR) ACTIVITY FIBROGEN, INC. 2010-12-30 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 (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-20100330199-A1 ISOTHIAZOLE-PYRIDINE DERIVATES AS MODULATORS OF HIF (HYPOXIA INDUCIBLE FACTOR) ACTIVITY HIF1A, HIF1AN, EGLN3 CDC7 2172/4885DBF4 2383/4885NPC1 3156/4885
US-20150209336-A1 ISOTHIAZOLE-PYRIDINE DERIVATIVES AS MODULATORS OF HIF (HYPOXIA INDUCIBLE FACTOR) ACTIVITY HIF1A, HIF1AN, EGLN3 CDC7 2097/4885DBF4 2434/4885NPC1 3160/4885

“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.