SCHEMBL6260990

SCHEMBL6260990

[CH2]NC(C)c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 2/20 0.50
▸ HPGD P15428 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ FFAR2 O15552 1/20 0.41
▸ TSHR P16473 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ HIF1A Q16665 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ CNR2 P34972 2/20 0.40
▸ LMNA P02545 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP2A6 P11509 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ AKT1 P31749 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ CRHBP P24387 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CRHR2 Q13324 1/20 0.38
▸ BRD4 O60885 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
SCHEMBL10315779 0.81 ADRB2 (0.56) ADRB2HPGDSMN1; SMN2GAAFFAR2
SCHEMBL10087172 0.81 ADRB2 (0.56) ADRB2HPGDSMN1; SMN2GAAFFAR2
SCHEMBL19286210 0.80 ADRB2 (0.54) ADRB2HPGDSMN1; SMN2GAAFFAR2
SCHEMBL2669157 0.78 ADRB2 (0.52) ADRB2HPGDSMN1; SMN2GAAFFAR2
SCHEMBL8353370 0.78 ADRB2 (0.52) ADRB2HPGDSMN1; SMN2GAAFFAR2
SCHEMBL178627 0.78 ADRB2 (0.52) ADRB2HPGDSMN1; SMN2GAAFFAR2
SCHEMBL11633101 0.76 ADRB2 (0.56) ADRB2HPGDSMN1; SMN2GAAFFAR2
Hydrochloric Acid SCHEMBL20303161 0.76 ADRB2 (0.50) ADRB2HPGDSMN1; SMN2GAAFFAR2
Hydrochloric Acid SCHEMBL20303159 0.76 ADRB2 (0.50) ADRB2HPGDSMN1; SMN2GAAFFAR2
SCHEMBL1231248 0.75 CYP3A4 (0.48) SMN1; SMN2GAALMNAALDH1A1MEN1

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-20050171132-A1 Diaminopyrimidine derivatives as selective growth hormone secrectgogue receptor (GHS-R) antagonists XIN ZHILI (US) 2005-08-04 — — US disclosed
US-20050171131-A1 Diaminopyrimidine derivatives as growth hormone secrectgogue receptor (GHS-R) antagonists KOSOGOF CHRISTI (US) 2005-08-04 — — US disclosed
WO-2005030734-A1 DIAMINOPYRIMIDINE DERIVATIVES AS SELECTIVE GROWTH HORMONE SECRECTGOGUE RECEPTOR (GHS-R) ANTAGONISTS ABBOTT LABORATORIES (US) 2005-04-07 — — WO disclosed
US-20050070712-A1 Pyrimidine derivatives as ghrelin receptor modulators ABBOTT LABORATORIES 2005-03-31 — — 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-20050171131-A1 Diaminopyrimidine derivatives as growth hormone secrectgogue receptor (GHS-R) antagonists GHSR, GIPR, GPR119 ADRB2 1999/4885HPGD 231/4885SMN1; SMN2 2223/4885
US-20050171132-A1 Diaminopyrimidine derivatives as selective growth hormone secrectgogue receptor (GHS-R) antagonists GHSR, GIPR, GPR119 ADRB2 1930/4885HPGD 311/4885SMN1; SMN2 2580/4885
US-20050070712-A1 Pyrimidine derivatives as ghrelin receptor modulators GPR119, GIPR, GCGR ADRB2 1047/4885HPGD 893/4885SMN1; SMN2 2298/4885

“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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