SCHEMBL21243273

SCHEMBL21243273

CC(Cc1ccccc1)NC(C)Cc1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 9/20 0.73
TAAR1 Q96RJ0 4/20 0.71
SLC18A2 Q05940 1/20 0.71
MEN1 O00255 1/20 0.61
KMT2A Q03164 1/20 0.61
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2D6 P10635 1/20 0.59
TSHR P16473 1/20 0.59
LMNA P02545 1/20 0.56
MAOA P21397 1/20 0.56
SLC6A2 P23975 1/20 0.56
SLC6A4 P31645 1/20 0.56
SLC6A3 Q01959 1/20 0.56

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
SCHEMBL28534586 0.91 SIGMAR1 (0.63) SIGMAR1TAAR1SLC18A2MEN1KMT2A
SCHEMBL28530803 0.91 SIGMAR1 (0.63) SIGMAR1TAAR1SLC18A2MEN1KMT2A
SCHEMBL28530801 0.91 SIGMAR1 (0.63) SIGMAR1TAAR1SLC18A2MEN1KMT2A
SCHEMBL25589819 0.91 SIGMAR1 (0.68) SIGMAR1TAAR1SLC18A2MEN1KMT2A
SCHEMBL5072573 0.91 SIGMAR1 (0.68) SIGMAR1TAAR1SLC18A2MEN1KMT2A
SCHEMBL5072576 0.91 SIGMAR1 (0.68) SIGMAR1TAAR1SLC18A2MEN1KMT2A
Hydrochloric Acid SCHEMBL7037528 0.89 SIGMAR1 (0.66) SIGMAR1TAAR1SLC18A2MEN1KMT2A
Hydrochloric Acid SCHEMBL7037524 0.89 SIGMAR1 (0.66) SIGMAR1TAAR1SLC18A2MEN1KMT2A
SCHEMBL20822465 0.88 SIGMAR1 (0.59) SIGMAR1TAAR1SLC18A2MEN1KMT2A
SCHEMBL28002406 0.87 SIGMAR1 (0.63) SIGMAR1TAAR1SLC18A2MEN1KMT2A

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-20190248958-A1 PREPARATION METHOD OF OLIGOMER ADDITIVE, OLIGOMER ADDITIVE, AND LITHIUM BATTERY NATIONAL TAIWAN UNIVERSITY OF SCIENCE AND TECHNOLOGY (TW) 2019-08-15 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-20190248958-A1 PREPARATION METHOD OF OLIGOMER ADDITIVE, OLIGOMER ADDITIVE, AND LITHIUM BATTERY PCNA, SCO2, PARG SIGMAR1 3706/4885TAAR1 2580/4885SLC18A2 2729/4885

“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.