SCHEMBL16624583

SCHEMBL16624583

NCc1cccc(CI)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 4/20 0.55
PNMT P11086 1/20 0.54
ENPP2 Q13822 1/20 0.54
PRMT6 Q96LA8 1/20 0.48
NOS1 P29475 8/20 0.47
NOS2 P35228 8/20 0.47
NOS3 P29474 6/20 0.47
ALDH1A1 P00352 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CYP3A4 P08684 1/20 0.47
NFKB1 P19838 1/20 0.47
NCF1 P14598 1/20 0.44
HRH3 Q9Y5N1 1/20 0.42
TAAR1 Q96RJ0 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41

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
SCHEMBL646951 0.87 ALDH1A1 (0.43) LOXL2PNMTENPP2PRMT6NOS1
SCHEMBL36008 0.87 LOXL2 (0.71) LOXL2PNMTENPP2PRMT6NOS1
SCHEMBL10422276 0.87 LOXL2 (0.71) LOXL2PNMTENPP2PRMT6NOS1
Water SCHEMBL28545356 0.84 LOXL2 (0.67) LOXL2PNMTENPP2PRMT6NOS1
Bromide SCHEMBL29013587 0.84 LOXL2 (0.67) LOXL2PNMTENPP2PRMT6NOS1
Ammonia Solution, Strong SCHEMBL6899866 0.84 LOXL2 (0.67) LOXL2PNMTENPP2PRMT6NOS1
Hydrochloric Acid SCHEMBL8195914 0.84 LOXL2 (0.67) LOXL2PNMTENPP2PRMT6NOS1
SCHEMBL7883952 0.84 LOXL2 (0.67) LOXL2PNMTENPP2PRMT6NOS1
Hydrochloric Acid SCHEMBL6018896 0.84 LOXL2 (0.67) LOXL2PNMTENPP2PRMT6NOS1
Bromide SCHEMBL28362115 0.84 LOXL2 (0.67) LOXL2PNMTENPP2PRMT6NOS1

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-20200270287-A1 Reagents Useful for Synthesizing Rhodamine-Labeled Oligonucleotides APPLIED BIOSYSTEMS, LLC (US) 2020-08-27 US disclosed
US-9783560-B2 Reagents useful for synthesizing rhodamine-labeled oligonucleotides APPLIED BIOSYSTEMS, LLC (US) 2017-10-10 US disclosed
WO-2015049229-A1 MULTI-COMPONENT EPOXY RESIN COMPOSITION BASF SE (DE) 2015-04-09 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-20200270287-A1 Reagents Useful for Synthesizing Rhodamine-Labeled Oligonucleotides RTCB, RRM2B, SNRPE LOXL2 3514/4885PNMT 732/4885ENPP2 1685/4885

“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.