SCHEMBL5432337

SCHEMBL5432337

CC1CCC(c2cc(-c3ccccc3O)nc(N)n2)CN1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ MAPK10 P53779 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ CDK1 P06493 6/20 0.48
▸ CDK2 P24941 6/20 0.48
▸ IKBKB O14920 4/20 0.41
▸ CHUK O15111 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ NR1I2 O75469 4/20 0.38
▸ SMARCA2 P51531 4/20 0.38
▸ SMARCA4 P51532 4/20 0.38
▸ PBRM1 Q86U86 4/20 0.38
▸ NR1H2 P55055 2/20 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
SCHEMBL5435591 0.80 CDK2 (0.69) SMN1; SMN2MEN1LMNACYP1A2MAPT
Hydrochloric Acid SCHEMBL5425696 0.79 CDK2 (0.67) SMN1; SMN2MEN1LMNACYP1A2MAPT
SCHEMBL5430039 0.76 IKBKB (0.51) IKBKBCHUK
SCHEMBL5431378 0.74 IKBKB (0.62) SMN1; SMN2MEN1LMNACYP1A2MAPT
SCHEMBL5718611 0.70 MEN1 (0.52) SMN1; SMN2MEN1LMNACYP1A2MAPT
SCHEMBL5422645 0.69 CDK1 (0.59) SMN1; SMN2MEN1LMNACYP1A2MAPT
SCHEMBL14359173 0.69 SMN1; SMN2 (0.66) SMN1; SMN2MEN1LMNACYP1A2MAPT
Hydrochloric Acid SCHEMBL5432381 0.68 CDK1 (0.58) MEN1MAPTKMT2ACDK1CDK2
SCHEMBL5429356 0.68 CDK2 (0.68) CDK1CDK2IKBKBCHUK
SCHEMBL5750484 0.67 CDK1 (0.43) SMN1; SMN2MEN1LMNACYP1A2MAPT

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-20070265289-A1 2-Aminopyrimidine Derivative ASTELLAS PHARMA INC. (JP) 2007-11-15 — — US disclosed
EP-1736472-A1 2-AMINOPYRIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2006-12-27 — — 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-20070265289-A1 2-Aminopyrimidine Derivative NFKBIA, IKBKG, NFKB2 SMN1; SMN2 3452/4885MEN1 4512/4885LMNA 4358/4885

“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.

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