SCHEMBL351473

SCHEMBL351473

NCc1ccc(-c2ccc(CN)cn2)nc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 9/20 0.46
HRH3 Q9Y5N1 1/20 0.43
ADRB2 P07550 1/20 0.41
CCR1 P32246 1/20 0.40
CCR5 P51681 1/20 0.40
CCR8 P51685 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
ABAT P80404 1/20 0.40
RRM2 P31350 1/20 0.40
LOX P28300 2/20 0.38
CYP2A6 P11509 1/20 0.38
CYP11B1 P15538 2/20 0.37
CYP11B2 P19099 2/20 0.37
TAAR1 Q96RJ0 1/20 0.37
LOXL3 P58215 1/20 0.37

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
SCHEMBL25162016 0.86 ADRB2 (0.41) LOXL2HRH3ADRB2ABATRRM2
SCHEMBL31120747 0.85 KDM4E (0.54) LOXL2ADRB2CCR1CCR5CCR8
SCHEMBL12486607 0.85 KDM4E (0.54) LOXL2ADRB2CCR1CCR5CCR8
SCHEMBL1720975 0.83 CYP11B1 (0.59) LOXL2CYP2A6CYP11B1CYP11B2TAAR1
SCHEMBL30083539 0.83 CYP11B1 (0.59) LOXL2CYP2A6CYP11B1CYP11B2TAAR1
SCHEMBL14355099 0.81 CYP11B1 (0.57) LOXL2ADRB2CYP2A6CYP11B1CYP11B2
Hydrochloric Acid SCHEMBL5010818 0.81 CYP11B1 (0.57) LOXL2CYP11B1CYP11B2TAAR1
SCHEMBL28956571 0.80 AOC3 (0.39) LOXL2CCR1CCR5CCR8HDAC6
Hydrochloric Acid SCHEMBL31716140 0.80 CYP11B1 (0.54) LOXL2HRH3ADRB2CYP11B1CYP11B2
SCHEMBL6673316 0.80 AURKA (0.54) HRH3CCR1CCR5CCR8HDAC6

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-8951400-B2 Chemistry used in biosensors OHMX CORPORATION (US) 2015-02-10 US disclosed
WO-2012012537-A1 NOVEL CHEMISTRY USED IN BIOSENSORS OHMX CORPORATION (US) 2012-01-26 WO disclosed
US-20120012472-A1 NOVEL CHEMISTRY USED IN BIOSENSORS OHMX CORPORATION (US) 2012-01-19 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 (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-20120012472-A1 NOVEL CHEMISTRY USED IN BIOSENSORS SSBP1, OSGEP, OCIAD2 LOXL2 2384/4885HRH3 4746/4885ADRB2 4452/4885

“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.