SCHEMBL3639719

SCHEMBL3639719

c1ccc(N2CCN(c3nc(N4CCCCC4)nc4ccccc34)CC2)cc1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.85
HPGD P15428 4/20 0.85
GLA P06280 3/20 0.85
GAA P10253 3/20 0.85
HSD17B10 Q99714 3/20 0.85
TSHR P16473 1/20 0.85
KDM4E B2RXH2 6/20 0.77
ALDH1A1 P00352 4/20 0.77
ABCG2 Q9UNQ0 1/20 0.61
ATM Q13315 2/20 0.59
MAPK1 P28482 1/20 0.59
CTDSP1 Q9GZU7 1/20 0.59
ACP1 P24666 2/20 0.58
LMNA P02545 2/20 0.58
ALOX15 P16050 1/20 0.58
HTT P42858 1/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
DCTPP1 Q9H773 1/20 0.58
GBA1 P04062 1/20 0.58

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
SCHEMBL1090785 0.92 L3MBTL1 (1.00) L3MBTL1HPGDGLAGAAHSD17B10
SCHEMBL1091130 0.92 L3MBTL1 (1.00) L3MBTL1HPGDGLAGAAHSD17B10
SCHEMBL3640898 0.92 L3MBTL1 (0.72) L3MBTL1HPGDGLAGAAHSD17B10
SCHEMBL30454930 0.91 L3MBTL1 (0.97) L3MBTL1HPGDGLAGAAHSD17B10
SCHEMBL11738679 0.91 L3MBTL1 (0.97) L3MBTL1HPGDGLAGAAHSD17B10
SCHEMBL3641129 0.91 L3MBTL1 (0.74) L3MBTL1HPGDGLAGAAHSD17B10
SCHEMBL3675539 0.82 L3MBTL1 (0.80) L3MBTL1HPGDGLAGAAHSD17B10
SCHEMBL14504432 0.82 LMNA (0.60) L3MBTL1HPGDGLAGAAHSD17B10
SCHEMBL3642537 0.82 L3MBTL1 (0.78) L3MBTL1HPGDGLAGAAHSD17B10
Hydrochloric Acid SCHEMBL3670729 0.81 L3MBTL1 (0.78) L3MBTL1HPGDGLAGAAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100317607-A1 USE OF COMPOUNDS FOR PREPARING ANTI-TUBERCULOSIS AGENTS INFECTIOUS DISEASE RESEARCH INSTITUTE (US) 2010-12-16 US claimed
CN-101784276-A Use of compounds for the preparation of antituberculosis agents SUMMIT CORP PLC 2010-07-21 CN claimed
US-20100317607-A1 USE OF COMPOUNDS FOR PREPARING ANTI-TUBERCULOSIS AGENTS INFECTIOUS DISEASE RESEARCH INSTITUTE (US) 2010-12-16 US disclosed
CN-101784276-A Use of compounds for the preparation of antituberculosis agents SUMMIT CORP PLC 2010-07-21 CN disclosed
EP-2173346-A2 USE OF COMPOUNDS FOR PREPARING ANTI-TUBERCULOSIS AGENTS Summit Corporation Plc (GB) 2010-04-14 EP disclosed
WO-2009001060-A2 USE OF COMPOUNDS FOR PREPARING ANTI-TUBERCULOSIS AGENTS SUMMIT CORPORATION PLC (GB) 2008-12-31 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-20100317607-A1 USE OF COMPOUNDS FOR PREPARING ANTI-TUBERCULOSIS AGENTS TPX2, DCXR, RRM2 L3MBTL1 3143/4885HPGD 953/4885GLA 636/4885

“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.