SCHEMBL10107615

SCHEMBL10107615

CCCCOc1c(Br)nc(N)c(C)c1C(=O)Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.42
CYP1A2 P05177 3/20 0.42
CYP2C19 P33261 3/20 0.42
CYP2C9 P11712 2/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 3/20 0.41
NPC1 O15118 4/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
NFKB1 P19838 3/20 0.40
NFKB2 Q00653 3/20 0.40
RELA Q04206 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
FAAH O00519 7/20 0.40
MAPT P10636 4/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL10107616 0.91 LMNA (0.42) LMNACYP1A2CYP2C19CYP2C9TSHR
SCHEMBL10107474 0.90 LMNA (0.44) LMNACYP1A2CYP2C19CYP2C9TSHR
SCHEMBL10107717 0.87 LMNA (0.42) LMNACYP1A2CYP2C19CYP2C9TSHR
SCHEMBL10107479 0.87 LMNA (0.42) LMNACYP1A2CYP2C19CYP2C9TSHR
SCHEMBL10102077 0.85 PTPN1 (0.41) LMNATSHRKMT2AMAPTRAB9A
SCHEMBL10107486 0.85 LMNA (0.41) LMNACYP1A2CYP2C19CYP2C9TSHR
SCHEMBL13074563 0.83 THRA (0.42) LMNACYP1A2TSHRNPC1CYP2D6
SCHEMBL10107513 0.82 MAPT (0.41) LMNACYP1A2CYP2C19CYP2C9TSHR
SCHEMBL10107487 0.81 MAPT (0.39) LMNACYP1A2CYP2C19CYP2C9TSHR
SCHEMBL15521209 0.79 FAAH (0.41) LMNACYP1A2CYP2C19CYP2C9TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8828988-B2 8-AZA tetracycline compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2014-09-09 US disclosed
US-8367654-B2 8-AZA tetracycline compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2013-02-05 US disclosed
US-20120108569-A1 8-AZA Tetracycline Compounds TETRAPHASE PHARMACEUTICALS, INC. 2012-05-03 US disclosed
WO-2010129055-A1 8-AZA TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS, INC. (US) 2010-11-11 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-20120108569-A1 8-AZA Tetracycline Compounds TET1, TET3, HDAC8 LMNA 3433/4885CYP1A2 530/4885CYP2C19 433/4885

“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.