SCHEMBL3431068

SCHEMBL3431068

CCN(CC)C1CCN(C(=O)Cl)C1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.40
ACKR3 P25106 1/20 0.39
POLR1A O95602 1/20 0.38
CBX7 O95931 2/20 0.38
CDYL2 Q8N8U2 2/20 0.38
CDYL Q9Y232 2/20 0.38
JAK1 P23458 1/20 0.36
CDY1; CDY1B Q9Y6F8 1/20 0.35
MCHR1 Q99705 1/20 0.35
ALDH1A1 P00352 1/20 0.34
L3MBTL3 Q96JM7 1/20 0.34
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
KDM1A O60341 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33

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
SCHEMBL13616203 1.00 KMT2A (0.40) KMT2AACKR3POLR1ACBX7CDYL2
SCHEMBL7970805 0.89 ACKR3 (0.43) KMT2AACKR3POLR1ACBX7CDYL2
SCHEMBL27788065 0.85 MCHR1 (0.42) KMT2AACKR3POLR1ACBX7CDYL2
SCHEMBL3399163 0.84 KMT2A (0.41) KMT2AACKR3POLR1ACBX7CDYL2
SCHEMBL3399165 0.84 KMT2A (0.41) KMT2AACKR3POLR1ACBX7CDYL2
SCHEMBL10196415 0.84 KMT2A (0.41) KMT2AACKR3POLR1ACBX7CDYL2
SCHEMBL3507064 0.84 KMT2A (0.41) KMT2AACKR3POLR1ACBX7CDYL2
SCHEMBL8152193 0.84 KMT2A (0.41) KMT2AACKR3POLR1ACBX7CDYL2
SCHEMBL3939589 0.82 KMT2A (0.40) KMT2AACKR3POLR1ACBX7CDYL2
Hydrochloric Acid SCHEMBL3399186 0.82 KMT2A (0.40) KMT2AACKR3POLR1ACBX7CDYL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117327084-A Berberine derivatives, preparation method thereof and application thereof in antiviral and leukopenia treatment 中国医学科学院医药生物技术研究所 2024-01-02 CN disclosed
EP-2250167-A1 ARYLMETHYLIDENE HETEROCYCLES AS NOVEL ANALGESICS Chlorion Pharma, Inc. (CA) 2010-11-17 EP disclosed
US-20090275538-A1 ARYLMETHYLIDENE HETEROCYCLES AS NOVEL ANALGESICS UNIVERSITE LAVAL (CA) 2009-11-05 US disclosed
US-20090275538-A1 ARYLMETHYLIDENE HETEROCYCLES AS NOVEL ANALGESICS UNIVERSITE LAVAL (CA) 2009-11-05 US disclosed
WO-2009097695-A1 ARYLMETHYLIDENE HETEROCYCLES AS NOVEL ANALGESICS CHLORION PHARMA, INC. (CA) 2009-08-13 WO disclosed
WO-2009097695-A1 ARYLMETHYLIDENE HETEROCYCLES AS NOVEL ANALGESICS CHLORION PHARMA, INC. (CA) 2009-08-13 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-20090275538-A1 ARYLMETHYLIDENE HETEROCYCLES AS NOVEL ANALGESICS OPRL1, OPRK1, AHR KMT2A 1752/4885ACKR3 144/4885POLR1A 4791/4885

“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.