SCHEMBL20725527

SCHEMBL20725527

NCc1cccc(C(N)CCc2ccccc2)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.48
ANPEP P15144 4/20 0.44
ERAP1 Q9NZ08 4/20 0.44
ERAP2 Q6P179 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CYP2A6 P11509 1/20 0.41
HTR2A P28223 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
IDO1 P14902 1/20 0.40
TDO2 P48775 1/20 0.40
PNMT P11086 1/20 0.40
ENPP2 Q13822 1/20 0.40
ACP3 P15309 1/20 0.40
HTR6 P50406 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
KCNH2 Q12809 1/20 0.39
KMT2A Q03164 1/20 0.38

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
SCHEMBL20725551 0.89 ANPEP (0.46) LOXL2ANPEPERAP1ERAP2SMN1; SMN2
SCHEMBL5924988 0.83 ANPEP (0.50) LOXL2ANPEPERAP1ERAP2SMN1; SMN2
SCHEMBL855071 0.83 ANPEP (0.50) LOXL2ANPEPERAP1ERAP2SMN1; SMN2
SCHEMBL8067078 0.83 ANPEP (0.50) LOXL2ANPEPERAP1ERAP2SMN1; SMN2
SCHEMBL27348015 0.81 OPRK1 (0.47) ANPEPERAP1ERAP2SMN1; SMN2HTR2A
Hydrochloric Acid SCHEMBL9635016 0.81 ANPEP (0.48) LOXL2ANPEPERAP1ERAP2SMN1; SMN2
SCHEMBL20725548 0.80 GAA (0.53) KCNH2
SCHEMBL6432692 0.79 ANPEP (0.50) LOXL2ANPEPERAP1ERAP2SMN1; SMN2
SCHEMBL27651491 0.79 KMT2A (0.45) LOXL2ANPEPERAP1SMN1; SMN2ENPP2
SCHEMBL27276979 0.77 PNMT (0.44) LOXL2ANPEPSMN1; SMN2PNMTENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10941242-B2 Amine compound, amine composition, and epoxy resin curing agent MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-03-09 US disclosed
EP-3441385-B1 AMINE COMPOUND, AMINE COMPOSITION, AND EPOXY RESIN CURING AGENT MITSUBISHI GAS CHEMICAL CO (JP) 2020-09-02 EP disclosed
US-20190112416-A1 AMINE COMPOUND, AMINE COMPOSITION, AND EPOXY RESIN CURING AGENT MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2019-04-18 US disclosed
EP-3441385-A1 AMINE COMPOUND, AMINE COMPOSITION, AND EPOXY RESIN CURING AGENT Mitsubishi Gas Chemical Company, Inc. (JP) 2019-02-13 EP 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 (2 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-20190112416-A1 AMINE COMPOUND, AMINE COMPOSITION, AND EPOXY RESIN CURING AGENT EHMT1, SETDB1, DOT1L LOXL2 1215/4885ANPEP 1395/4885ERAP1 639/4885
US-10941242-B2 Amine compound, amine composition, and epoxy resin curing agent EHMT1, SETDB1, DOT1L LOXL2 1215/4885ANPEP 1395/4885ERAP1 639/4885

“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.