SCHEMBL3783036

SCHEMBL3783036

CCCCOC(=O)c1nc(-c2cnccn2)c2snc(C)c2c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.41
DBF4 Q9UBU7 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
MAPT P10636 3/20 0.38
MEN1 O00255 2/20 0.38
HPGD P15428 2/20 0.38
KMT2A Q03164 2/20 0.38
RAB9A P51151 2/20 0.38
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP2D6 P10635 1/20 0.37
CYP19A1 P11511 1/20 0.37
LMNA P02545 3/20 0.36
ESR1 P03372 5/20 0.35
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
GLA P06280 1/20 0.32

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
SCHEMBL3787159 0.92 CDC7 (0.41) CDC7DBF4L3MBTL1MAPTMEN1
SCHEMBL3404472 0.86 APP (0.43) L3MBTL1HPGDRAB9ACYP2C9CYP2C19
SCHEMBL3788294 0.84 L3MBTL1 (0.47) CDC7DBF4L3MBTL1MAPTMEN1
SCHEMBL3404112 0.80 EGFR (0.43) L3MBTL1ESR1ALDH1A1TSHRAPP
SCHEMBL3402955 0.80 ESR1 (0.42) L3MBTL1MAPTRAB9ACYP2C19CYP2D6
SCHEMBL3401833 0.79 ESR1 (0.41) L3MBTL1MAPTRAB9ACYP2C19CYP2D6
SCHEMBL3407508 0.78 ESR1 (0.40) L3MBTL1MAPTRAB9ACYP2C19CYP2D6
SCHEMBL3401248 0.77 ESR1 (0.41) L3MBTL1MAPTRAB9ACYP2C19CYP2D6
SCHEMBL3403659 0.77 EGLN1 (0.43)
SCHEMBL3401390 0.76 ESR1 (0.42) L3MBTL1MAPTRAB9ACYP2C9CYP2C19

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 2383/4885L3MBTL1 4161/4885
US-20150209336-A1 ISOTHIAZOLE-PYRIDINE DERIVATIVES AS MODULATORS OF HIF (HYPOXIA INDUCIBLE FACTOR) ACTIVITY HIF1A, HIF1AN, EGLN3 CDC7 2097/4885DBF4 2434/4885L3MBTL1 4160/4885

“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.