SCHEMBL23959844

SCHEMBL23959844

C=C(Nc1cccc2cccnc12)C1CC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
TDP1 Q9NUW8 3/20 0.52
POLB P06746 2/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
CASP3 P42574 1/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
KDR P35968 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
MAPT P10636 2/20 0.50
HIF1A Q16665 1/20 0.50
KDM4E B2RXH2 2/20 0.49
HDAC6 Q9UBN7 1/20 0.49
RECQL P46063 1/20 0.49
WNT3 P56703 1/20 0.48
HTT P42858 3/20 0.48
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL23959845 0.82 CYP1A2 (0.63) CYP1A2CYP3A4TDP1POLBMEN1
SCHEMBL31321007 0.82 WNT3 (0.66) CYP1A2CYP3A4TDP1POLBMEN1
SCHEMBL22264710 0.82 WNT3 (0.66) CYP1A2CYP3A4TDP1POLBMEN1
SCHEMBL31406374 0.77 ALDH1A1 (0.61) TDP1POLBMEN1KMT2ACASP3
SCHEMBL28400031 0.77 ALDH1A1 (0.65) TDP1POLBMEN1KMT2ACASP3
SCHEMBL16456024 0.76 WNT3 (0.60) TDP1POLBMEN1KMT2ACASP3
SCHEMBL16456004 0.76 WNT3 (0.60) TDP1POLBMEN1KMT2ACASP3
SCHEMBL28400036 0.75 ALDH1A1 (0.67) TDP1POLBMEN1KMT2ACASP3
SCHEMBL27599095 0.74 TDP1 (0.67) CYP1A2CYP3A4TDP1POLBMEN1
SCHEMBL6720632 0.74 CYP1A2 (0.65) CYP1A2CYP3A4TDP1POLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210332038-A1 6H-IMIDAZO[4,5,1-ij]QUINOLONE, SYNTHESIS METHOD AND USE THEREOF HANGZHOU NORMAL UNIVERSITY 2021-10-28 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-20210332038-A1 6H-IMIDAZO[4,5,1-ij]QUINOLONE, SYNTHESIS METHOD AND USE THEREOF ABL1, KCNK4, KCNJ4 CYP1A2 239/4885CYP3A4 20/4885TDP1 4114/4885

“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.