SCHEMBL5433262

SCHEMBL5433262

CC/C(=N\O)c1ccc(-c2ccccn2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.49
CYP2D6 P10635 1/20 0.49
CYP19A1 P11511 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
ATM Q13315 1/20 0.44
TRPV1 Q8NER1 2/20 0.43
KDM4E B2RXH2 3/20 0.42
LMNA P02545 3/20 0.42
USP2 O75604 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
HTT P42858 1/20 0.42
NPC1 O15118 1/20 0.42
HSP90AA1 P07900 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ABL1 P00519 1/20 0.42
BCR P11274 1/20 0.42
SLC6A7 Q99884 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
SCHEMBL5433266 1.00 CYP1A2 (0.49) CYP1A2CYP2D6CYP19A1CYP2C9CYP2C19
SCHEMBL6935958 0.79 KDM4E (0.53) CYP1A2CYP2D6CYP19A1CYP2C9CYP2C19
SCHEMBL8308609 0.78 ATM (0.55) ATMKDM4EUSP2SMN1; SMN2MEN1
SCHEMBL5415248 0.78 MAPT (0.61) CYP1A2CYP2D6CYP19A1CYP2C9CYP2C19
SCHEMBL10041972 0.77 ATM (0.71) CYP19A1ATMKDM4ELMNAHTT
SCHEMBL264821 0.77 ATM (0.71) CYP19A1ATMKDM4ELMNAHTT
SCHEMBL2776027 0.77 ATM (0.71) CYP19A1ATMKDM4ELMNAHTT
SCHEMBL14153525 0.76 KDM1A (0.48) CYP1A2TRPV1KDM4ELMNAABL1
SCHEMBL28059946 0.75 ATM (0.68) CYP19A1ATMKDM4ELMNAHTT
SCHEMBL20399822 0.74 KDM4E (0.50) CYP1A2ATMKDM4ELMNAUSP2

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-20070167490-A1 Imino ether derivative compounds and drugs containing the compounds as the active ingredient ONO PHARMACEUTICAL CO LTD 2007-07-19 US disclosed
EP-1602642-A1 IMINO ETHER DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2005-12-07 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 (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-20070167490-A1 Imino ether derivative compounds and drugs containing the compounds as the active ingredient INSR, NR1H2, NR1H3 CYP1A2 241/4885CYP2D6 321/4885CYP19A1 298/4885

“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.