SCHEMBL3188134

SCHEMBL3188134

CC(C)C(=O)c1c[nH]c2cc(Cl)ccc12

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 2/20 0.64
▸ F7 P08709 1/20 0.51
▸ F3 P13726 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ GPR84 Q9NQS5 1/20 0.50
▸ AVPR1A P37288 2/20 0.47
▸ HTR2A P28223 1/20 0.46
▸ HAT1 O14929 6/20 0.44
▸ EP300 Q09472 6/20 0.44

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
SCHEMBL24067322 0.88 F7 (0.69) NR4A2F7F3ALDH1A1KMT2A
SCHEMBL25742053 0.85 NR4A2 (0.62) NR4A2F7F3ALDH1A1KMT2A
SCHEMBL13533568 0.83 NR4A2 (0.63) NR4A2ALDH1A1KMT2AHTR2AHAT1
SCHEMBL25742059 0.82 NR4A2 (0.58) NR4A2ALDH1A1KMT2AHAT1EP300
SCHEMBL3182218 0.82 NR4A2 (0.69) NR4A2F7F3ALDH1A1GPR84
SCHEMBL613332 0.82 F7 (0.74) NR4A2F7F3ALDH1A1KMT2A
SCHEMBL30392504 0.82 F7 (0.74) NR4A2F7F3ALDH1A1KMT2A
SCHEMBL3181708 0.81 GPR84 (0.50) NR4A2ALDH1A1KMT2AGPR84HTR2A
SCHEMBL3174938 0.81 NR4A2 (0.49) NR4A2ALDH1A1KMT2A
Ammonia Solution, Strong SCHEMBL4556453 0.80 F7 (0.72) NR4A2F7F3ALDH1A1KMT2A

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230121337-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. 2023-04-20 — — US disclosed
US-20100016371-A1 Indole Compounds GLAXO GROUP LIMITED (GB) 2010-01-21 — — US disclosed
US-20100016371-A1 Indole Compounds GLAXO GROUP LIMITED (GB) 2010-01-21 — — US disclosed
US-20100016371-A1 Indole Compounds GLAXO GROUP LIMITED (GB) 2010-01-21 — — US disclosed
US-20090298866-A1 Indole Compounds GLAXO GROUP LIMITED (GB) 2009-12-03 — — US disclosed
US-20090298866-A1 Indole Compounds GLAXO GROUP LIMITED (GB) 2009-12-03 — — US disclosed
US-20090298866-A1 Indole Compounds GLAXO GROUP LIMITED (GB) 2009-12-03 — — US disclosed
EP-2044062-A1 INDOLE COMPOUNDS Glaxo Group Limited (GB) 2009-04-08 — — EP disclosed
EP-2041086-A1 INDOLE COMPOUNDS Glaxo Group Limited (GB) 2009-04-01 — — EP disclosed
WO-2008006793-A1 INDOLE COMPOUNDS GLAXO GROUP LIMITED (GB) 2008-01-17 — — WO disclosed
WO-2008006790-A1 INDOLE COMPOUNDS GLAXO GROUP LIMITED (GB) 2008-01-17 — — WO disclosed
WO-2008006790-A1 INDOLE COMPOUNDS GLAXO GROUP LIMITED (GB) 2008-01-17 — — WO disclosed
WO-2008006793-A1 INDOLE COMPOUNDS GLAXO GROUP LIMITED (GB) 2008-01-17 — — WO 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-20230121337-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CDK2, CDK20, CDK2AP2 NR4A2 3309/4885F7 4544/4885F3 3345/4885
US-20100016371-A1 Indole Compounds IDO1, TPH1, IDO2 NR4A2 3552/4885F7 1002/4885F3 116/4885
US-20090298866-A1 Indole Compounds IDO1, TPH1, IDO2 NR4A2 3518/4885F7 900/4885F3 95/4885

“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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