SCHEMBL1320867

SCHEMBL1320867

Cc1cccc(C(=O)N[C@H](C)c2ccc3ccccc3c2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ NPC1 O15118 1/20 0.59
▸ RAB9A P51151 1/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.59
▸ MMP9 P14780 1/20 0.57
▸ HPGDS O60760 2/20 0.55
▸ GPR139 Q6DWJ6 1/20 0.55
▸ PDE2A O00408 1/20 0.55
▸ ATM Q13315 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ KAT6A Q92794 1/20 0.52
▸ GAA P10253 1/20 0.51
▸ ROCK2 O75116 1/20 0.51
▸ ROCK1 Q13464 1/20 0.51
▸ TAS1R3 Q7RTX0 1/20 0.50
▸ TAS1R1 Q7RTX1 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ DRD2 P14416 1/20 0.49
▸ DRD3 P35462 1/20 0.49

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
SCHEMBL23839968 1.00 MEN1 (0.59) MEN1KMT2ANPC1RAB9AL3MBTL1
SCHEMBL12121924 0.87 MMP9 (0.64) MEN1KMT2ANPC1MMP9HPGDS
SCHEMBL1318145 0.86 HPGDS (0.60) MEN1KMT2ANPC1RAB9AMMP9
SCHEMBL1319215 0.84 GPR139 (0.65) MEN1KMT2ANPC1RAB9AMMP9
SCHEMBL29793739 0.81 ALDH1A1 (0.62) MEN1KMT2ANPC1GPR139ATM
SCHEMBL1643774 0.81 TP53 (0.55) MEN1KMT2ANPC1RAB9AMMP9
SCHEMBL1318551 0.81 MMP9 (0.59) MEN1KMT2AMMP9HPGDSPDE2A
SCHEMBL2409358 0.80 HDAC8 (0.67) MEN1KMT2ANPC1GPR139ATM
SCHEMBL1320071 0.80 MMP9 (0.58) MEN1KMT2ANPC1RAB9AMMP9
SCHEMBL30544977 0.79 MMP9 (0.69) MEN1KMT2AMMP9HPGDSPDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269834-A1 COMPOUNDS AND METHODS FOR TREATING RESPIRATORY DISEASES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2011-11-03 — — US disclosed
WO-2010022355-A1 COMPOUNDS AND METHODS FOR TREATING RESPIRATORY DISEASES PURDUE RESEARCH FOUNDATION (US) 2010-02-25 — — 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 (1 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-20110269834-A1 COMPOUNDS AND METHODS FOR TREATING RESPIRATORY DISEASES SARS1, ACE2, ACE MEN1 4233/4885KMT2A 3537/4885NPC1 89/4885

“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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