SCHEMBL15929467

SCHEMBL15929467

Cc1ccc(-c2ocnc2C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IMPDH2 P12268 2/20 0.50
▸ IMPDH1 P20839 1/20 0.49
▸ NOTUM Q6P988 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ ENPP3 O14638 1/20 0.38
▸ ENPP1 P22413 1/20 0.38
▸ MAPK14 Q16539 1/20 0.37
▸ HPGD P15428 2/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ UBE2N P61088 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ GPR119 Q8TDV5 1/20 0.36

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
SCHEMBL3998459 0.83 IMPDH2 (0.50) IMPDH2IMPDH1PKMMEN1KMT2A
SCHEMBL472455 0.83 MAPK14 (0.54) IMPDH2IMPDH1NOTUMNPC1MAPK14
SCHEMBL472411 0.83 GAA (0.49) IMPDH2IMPDH1NOTUMLMNAMEN1
SCHEMBL6168845 0.83 IMPDH2 (0.47) IMPDH2IMPDH1LMNAMEN1KMT2A
SCHEMBL472419 0.83 IMPDH2 (0.47) IMPDH2IMPDH1LMNANPC1MAPK14
SCHEMBL343219 0.83 ADORA2A (0.50) IMPDH2IMPDH1NOTUMLMNANPC1
Methane SCHEMBL17941330 0.82 IMPDH2 (0.46) IMPDH2IMPDH1LMNAMEN1KMT2A
SCHEMBL8066719 0.81 MAPK14 (0.56) NOTUMLMNAPKMMEN1KMT2A
SCHEMBL472791 0.80 GSK3B (0.46) IMPDH2IMPDH1LMNAMEN1KMT2A
SCHEMBL472451 0.79 NOTUM (0.47) IMPDH2IMPDH1NOTUMALDH1A1CCNB2

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-20160067224-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2016-03-10 — — US disclosed
US-9220710-B2 Therapeutic compounds GILEAD SCIENCES, INC. (US) 2015-12-29 — — US disclosed
US-20140221421-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. (US) 2014-08-07 — — 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-20160067224-A1 THERAPEUTIC COMPOUNDS HAVCR2, SARS1, G6PD IMPDH2 459/4885IMPDH1 172/4885NOTUM 1713/4885
US-20140221421-A1 THERAPEUTIC COMPOUNDS HAVCR2, SARS1, G6PD IMPDH2 459/4885IMPDH1 172/4885NOTUM 1713/4885

“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.

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