SCHEMBL19257741

SCHEMBL19257741

CNC(Cc1ccccc1)c1ccc(N(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.50
CNR2 P34972 1/20 0.49
ALDH1A1 P00352 3/20 0.47
KMT2A Q03164 3/20 0.47
TAAR1 Q96RJ0 2/20 0.46
SLC18A2 Q05940 1/20 0.46
SIGMAR1 Q99720 1/20 0.46
MAPK1 P28482 3/20 0.44
TDP1 Q9NUW8 2/20 0.42
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
POLB P06746 2/20 0.42
RXFP1 Q9HBX9 1/20 0.42
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTT P42858 2/20 0.41
MEN1 O00255 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
MAPT P10636 1/20 0.41
MMP9 P14780 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
SCHEMBL1541692 0.84 TAAR1 (0.57) SLC6A3ALDH1A1TAAR1SLC18A2SIGMAR1
SCHEMBL13621464 0.84 TAAR1 (0.57) SLC6A3ALDH1A1TAAR1SLC18A2SIGMAR1
SCHEMBL13621571 0.84 TAAR1 (0.57) SLC6A3ALDH1A1TAAR1SLC18A2SIGMAR1
SCHEMBL18917320 0.83 MAPT (0.48) SLC6A3CNR2ALDH1A1KMT2ASIGMAR1
SCHEMBL5981801 0.77 RAB9A (0.54) CNR2ALDH1A1KMT2AMAPK1POLB
SCHEMBL19257742 0.76 CNR2 (0.48) SLC6A3CNR2ALDH1A1KMT2ATAAR1
SCHEMBL9321453 0.76 SLC6A2 (0.59) SLC6A3ALDH1A1TAAR1SLC18A2SIGMAR1
SCHEMBL13971483 0.75 ADRB3 (0.49) ALDH1A1TAAR1SLC18A2SIGMAR1CYP2D6
Methamphetamine SCHEMBL11146875 0.75 SIGMAR1 (0.72) ALDH1A1KMT2ATAAR1SLC18A2SIGMAR1
SCHEMBL11099393 0.74 SMN1; SMN2 (0.49) ALDH1A1KMT2ATAAR1SLC18A2SIGMAR1

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-10723727-B2 Tubulysin analogs and methods for their preparation PFIZER INC. (US) 2020-07-28 US disclosed
WO-2017134547-A1 TUBULYSIN ANALOGS AND METHODS FOR THEIR PREPARATION PFIZER INC. (US) 2017-08-10 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-10723727-B2 Tubulysin analogs and methods for their preparation NGLY1, TEK, TEKT1 SLC6A3 1024/4885CNR2 4694/4885ALDH1A1 4715/4885

“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.