SCHEMBL2123261

SCHEMBL2123261

Cc1cc(C(C)NC(=O)c2ccccc2C=O)on1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ GLA P06280 1/20 0.44
▸ KMT2A Q03164 4/20 0.41
▸ KDM4E B2RXH2 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ USP2 O75604 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ LMNA P02545 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ THRB P10828 1/20 0.37

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
SCHEMBL9791867 0.75 ERN1 (0.47) ALDH1A1KMT2AKDM4EMEN1LMNA
SCHEMBL6623025 0.74 HDAC6 (0.50) ALDH1A1SMN1; SMN2GLAKMT2AUSP2
SCHEMBL24074314 0.71 ALDH1A1 (0.48) ALDH1A1KDM4ELMNAHPGDHSD17B10
SCHEMBL13451180 0.70 EPHX2 (0.49) ALDH1A1KDM4EGAANPC1RAB9A
SCHEMBL6387197 0.70 MEN1 (0.50) ALDH1A1SMN1; SMN2KMT2AKDM4ETSHR
SCHEMBL728983 0.66 GAA (0.55) ALDH1A1KMT2ATSHRGAAMEN1
SCHEMBL6960418 0.66 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2GLAKMT2AKDM4E
SCHEMBL17054195 0.66 HPGD (0.39) ALDH1A1SMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL7621910 0.65 CAPN1 (0.40) ALDH1A1KMT2AKDM4EMEN1LMNA
SCHEMBL4690330 0.65 RAB9A (0.64) ALDH1A1SMN1; SMN2KMT2AKDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120095011-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2012-04-19 — — US disclosed
US-20090131463-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2009-05-21 — — US disclosed
US-7521453-B2 e.g. 5-Bromo-2-(3-methylisoxazol-5-ylmethylamino)-4-(5-cyclopropyl- 1H-pyrazol-3-ylamino)pyrimidine; anticarcinogenic, antitumor agents; breast, prostate, colon cancer ASTRAZENECA AB (SE) 2009-04-21 — — US disclosed
EP-1456182-B1 PYRIMIDINE DERIVATIVES AS MODULATORS OF INSULINE-LIKE GROWTH FACTOR-1 RECEPTOR (IGF-I) ASTRAZENECA AB (SE) 2009-03-11 — — EP disclosed
US-20050054638-A1 Pyrimidine derivatives as modulators of insulin-like growth factor-1 receptor (igf-i) ASTRAZENECA AB 2005-03-10 — — 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 (3 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-20090131463-A1 NOVEL COMPOUNDS C1R, TBXA2R, F12 ALDH1A1 1142/4885SMN1; SMN2 2090/4885GLA 3764/4885
US-20120095011-A1 NOVEL COMPOUNDS C1R, TBXA2R, F12 ALDH1A1 1142/4885SMN1; SMN2 2090/4885GLA 3764/4885
US-20050054638-A1 Pyrimidine derivatives as modulators of insulin-like growth factor-1 receptor (igf-i) IGF1R, IGFBP1, INSR ALDH1A1 1133/4885SMN1; SMN2 1649/4885GLA 3324/4885

“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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