SCHEMBL5582687

SCHEMBL5582687

COc1ccc(Oc2ccc(CCC(=O)Nc3ccc(CC(=O)NCCN(C)C)cc3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
LMNA P02545 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
ALDH1A1 P00352 4/20 0.51
MAPT P10636 3/20 0.50
RAB9A P51151 1/20 0.50
CA12 O43570 2/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
CA9 Q16790 2/20 0.48
TSHR P16473 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
EPHX2 P34913 1/20 0.47
KLK7 P49862 1/20 0.47

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
SCHEMBL14454895 0.82 ACHE (0.58) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL5582690 0.80 MAPK1 (0.55) POLBLMNASMN1; SMN2MEN1KMT2A
SCHEMBL5582701 0.76 EPHX2 (0.66) POLBLMNASMN1; SMN2KMT2AALDH1A1
SCHEMBL30034264 0.74 SMN1; SMN2 (0.88) POLBLMNASMN1; SMN2MEN1KMT2A
SCHEMBL10144743 0.74 SMN1; SMN2 (0.72) POLBLMNASMN1; SMN2MEN1KMT2A
SCHEMBL16560992 0.74 KMT2A (0.74) MEN1KMT2AALDH1A1MAPTRAB9A
SCHEMBL15648214 0.74 FPR2 (0.67) POLBMEN1KMT2AALDH1A1MAPT
SCHEMBL3676320 0.74 RAB9A (0.73) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL8605379 0.74 RAB9A (0.72) POLBSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL10954317 0.73 KMT2A (0.71) POLBSMN1; SMN2MEN1KMT2AALDH1A1

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-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US claimed
US-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
EP-1218336-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2002-07-03 EP disclosed
WO-2001021577-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-29 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-20070173498-A1 Melanin concentrating hormone antagonist MC1R, MCHR1, MCHR2 POLB 4114/4885LMNA 4047/4885SMN1; SMN2 3652/4885

“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.