SCHEMBL4999697

SCHEMBL4999697

C[C@@H](NCc1ccc(Cl)c(NC(=O)CCl)c1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.48
SMN1; SMN2 Q16637 6/20 0.48
HTT P42858 4/20 0.48
KDM4E B2RXH2 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
MAPT P10636 2/20 0.47
MAPK1 P28482 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
LMNA P02545 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
GPR139 Q6DWJ6 2/20 0.41
HDAC1 Q13547 1/20 0.41
APAF1 O14727 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 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
SCHEMBL4999861 1.00 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2HTTKDM4ETDP1
SCHEMBL4999756 0.89 SMN1; SMN2 (0.52) ALDH1A1SMN1; SMN2HTTKDM4ETDP1
SCHEMBL4996347 0.88 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2HTTKDM4ETDP1
SCHEMBL4999636 0.87 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2HTTKDM4ETDP1
SCHEMBL4540963 0.87 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2HTTKDM4ETDP1
SCHEMBL4540403 0.86 HDAC1 (0.53) ALDH1A1SMN1; SMN2KDM4EKMT2AMEN1
SCHEMBL4990054 0.86 HDAC1 (0.53) ALDH1A1SMN1; SMN2KDM4EKMT2AMEN1
SCHEMBL4999764 0.85 SMN1; SMN2 (0.51) ALDH1A1SMN1; SMN2HTTKDM4ETDP1
SCHEMBL5000002 0.85 MEN1 (0.47) ALDH1A1SMN1; SMN2HTTKDM4ETDP1
SCHEMBL4067216 0.84 HPGD (0.56) ALDH1A1SMN1; SMN2HTTKDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080221101-A1 Calcium receptor modulating agents AMGEN INC. (US) 2008-09-11 US claimed
US-8349831-B2 Osteoporosis, bone disorders, or diseases associated with excessive secretion of PTH, such as hyperparathyroidism; reduce or inhibit parathyroid hormone (PTH) secretion AMGEN INC. (US) 2013-01-08 US disclosed
US-8349831-B2 Osteoporosis, bone disorders, or diseases associated with excessive secretion of PTH, such as hyperparathyroidism; reduce or inhibit parathyroid hormone (PTH) secretion AMGEN INC. (US) 2013-01-08 US disclosed
US-8349831-B2 Osteoporosis, bone disorders, or diseases associated with excessive secretion of PTH, such as hyperparathyroidism; reduce or inhibit parathyroid hormone (PTH) secretion AMGEN INC. (US) 2013-01-08 US disclosed
US-20080221101-A1 Calcium receptor modulating agents AMGEN INC. (US) 2008-09-11 US disclosed
US-20080221101-A1 Calcium receptor modulating agents AMGEN INC. (US) 2008-09-11 US disclosed
US-20080221101-A1 Calcium receptor modulating agents AMGEN INC. (US) 2008-09-11 US disclosed
WO-2008057282-A1 CALCIUM RECEPTOR MODULATING AGENTS AMGEN INC. (US) 2008-05-15 WO 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-20080221101-A1 Calcium receptor modulating agents CASR, RYR1, RYR2 ALDH1A1 3089/4885SMN1; SMN2 2433/4885HTT 2526/4885

“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.