SCHEMBL2672167

SCHEMBL2672167

COCc1ccc2cccnc2c1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.51
NPC1 O15118 4/20 0.51
RAB9A P51151 4/20 0.51
HTT P42858 3/20 0.51
NPSR1 Q6W5P4 2/20 0.51
ALOX12 P18054 2/20 0.51
LMNA P02545 5/20 0.47
CCR1 P32246 3/20 0.47
CCR5 P51681 3/20 0.47
CCR8 P51685 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
TP53 P04637 2/20 0.47
MAPT P10636 2/20 0.47
ALOX15 P16050 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
GMNN O75496 1/20 0.47
HSP90AA1 P07900 1/20 0.47
MMP2 P08253 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47

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
SCHEMBL11102879 0.80 LMNA (0.54) KDM4ENPC1RAB9AHTTLMNA
SCHEMBL3145084 0.80 RAB9A (0.53) KDM4ENPC1RAB9AHTTNPSR1
SCHEMBL2671625 0.73 CCR1 (0.52) KDM4ENPC1RAB9AHTTNPSR1
SCHEMBL10911576 0.72 LMNA (0.63) KDM4EHTTNPSR1LMNACCR1
SCHEMBL18878184 0.72 HTT (0.47) KDM4ENPC1RAB9AHTTNPSR1
SCHEMBL23714117 0.69 KDM4E (0.69) KDM4ENPC1RAB9AHTTNPSR1
Phenanthroline SCHEMBL28877357 0.68 CCR1 (0.80) KDM4ENPC1RAB9AHTTLMNA
SCHEMBL1670591 0.68 CCR1 (0.58) KDM4EHTTLMNACCR1CCR5
SCHEMBL14842244 0.68 LMNA (0.58) KDM4ENPC1RAB9AHTTLMNA
SCHEMBL2672030 0.68 MMP2 (0.59) KDM4EHTTALOX12LMNACCR1

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-8173620-B2 BHQ-caged nucleotide probes photolysable by two-photon excitation UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2012-05-08 US disclosed
US-20100048502-A1 BHQ-CAGED NUCLEOTIDE PROBES PHOTOLYSABLE BY TWO-PHOTON EXCITATION NATIONAL SCIENCE FOUNDATION 2010-02-25 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-20100048502-A1 BHQ-CAGED NUCLEOTIDE PROBES PHOTOLYSABLE BY TWO-PHOTON EXCITATION NUDT1, RECQL, PNP KDM4E 971/4885NPC1 2335/4885RAB9A 1845/4885

“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.