SCHEMBL6080197

SCHEMBL6080197

Nc1c(-c2ccccc2)ccc2c(OCc3ccccc3)cc(C(=O)OCc3ccccc3)nc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.42
CYP11B2 P19099 2/20 0.42
CYP19A1 P11511 1/20 0.42
P2RY14 Q15391 1/20 0.41
NPSR1 Q6W5P4 2/20 0.40
MAPT P10636 2/20 0.40
MAP4K4 O95819 1/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
RAB9A P51151 2/20 0.38
TSHR P16473 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 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
SCHEMBL6593903 0.90 P2RY14 (0.46) CYP11B1CYP11B2CYP19A1P2RY14NPSR1
SCHEMBL6080642 0.88 P2RY14 (0.42) CYP11B1CYP11B2P2RY14MAPTRXRA
SCHEMBL6080943 0.86 FFAR1 (0.40) MAPTMAP4K4RAB9ATSHRCASP3
SCHEMBL6081081 0.86 PTGER1 (0.45) P2RY14RXRARXRBRXRGRAB9A
SCHEMBL6080347 0.82 MRGPRX4 (0.42) MAPTMAP4K4RAB9AL3MBTL1KMT2A
SCHEMBL6592323 0.79 MCL1 (0.48) P2RY14RXRARXRBRXRGPTGER1
SCHEMBL6079894 0.78 THRA (0.42) TSHRKMT2ASMN1; SMN2MEN1SLC6A2
SCHEMBL6080025 0.78 MRGPRX4 (0.42) MAPTRAB9ATSHRL3MBTL1KMT2A
SCHEMBL2906705 0.77 MAPT (0.49) MAPTL3MBTL1KMT2ASMN1; SMN2MEN1
SCHEMBL6080651 0.76 PTGER1 (0.42) RAB9ATSHRCASP3SENP8SENP7

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-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NEURO3D (FR) 2006-08-17 US claimed
US-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NEURO3D (FR) 2006-08-17 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-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NQO1, NQO2, RECQL CYP11B1 633/4885CYP11B2 477/4885CYP19A1 988/4885

“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.