SCHEMBL1180982

SCHEMBL1180982

Cc1cc(N)cc2c1[nH]c1ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.59
ABCB1 P08183 1/20 0.53
MAPT P10636 6/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CYP1A2 P05177 2/20 0.46
CYP2C19 P33261 1/20 0.46
TNKS2 Q9H2K2 1/20 0.46
ALDH1A1 P00352 4/20 0.45
HSD17B10 Q99714 4/20 0.45
GPR3 P46089 1/20 0.45
HPGD P15428 3/20 0.45
MAPK1 P28482 3/20 0.45
KDM4E B2RXH2 3/20 0.45
NPSR1 Q6W5P4 2/20 0.45
GABRP O00591 1/20 0.45
GABRD O14764 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
GABRA1 P14867 1/20 0.45

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
SCHEMBL15939764 0.84 PARP1 (0.46) KIF11ABCB1ALDH1A1PARP1
SCHEMBL28200469 0.83 KIF11 (0.53) KIF11ABCB1MAPTMEN1KMT2A
SCHEMBL20348696 0.81 ABCB1 (0.75) KIF11ABCB1MAPTMEN1KMT2A
SCHEMBL3887451 0.81 POLB (0.51) KIF11MAPTMEN1KMT2ACYP1A2
SCHEMBL1181051 0.79 KIF11 (0.55) KIF11ABCB1MAPTMEN1KMT2A
SCHEMBL27447266 0.79 KIF11 (0.59) KIF11ABCB1MAPTMEN1KMT2A
SCHEMBL31188776 0.79 KIF11 (0.59) KIF11ABCB1MAPTMEN1KMT2A
SCHEMBL3887813 0.79 FTO (0.54) KIF11MAPTMEN1KMT2AALDH1A1
SCHEMBL6826973 0.79 KIF11 (0.59) KIF11ABCB1MAPTMEN1KMT2A
SCHEMBL869230 0.78 MAPT (0.54) KIF11MAPTMEN1KMT2AALDH1A1

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
CN-107011342-A The preparation based on carboline and carbazole for detecting neurological dysfunction 伊莱利利公司 2017-08-04 CN disclosed
US-20110046378-A1 Novel Imaging Agents for Detecting Neurological Dysfunction SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2011-02-24 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-20110046378-A1 Novel Imaging Agents for Detecting Neurological Dysfunction FABP7, SLC18A3, TSPO KIF11 2051/4885ABCB1 1276/4885MAPT 35/4885

“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.