SCHEMBL3915463

SCHEMBL3915463

CC(C)(Cc1cccc(CC(=O)N2CCN(c3ccccn3)CC2)c1)NCC(O)c1cc(O)cc(O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.49
ALDH1A1 P00352 6/20 0.49
HPGD P15428 5/20 0.49
HSD17B10 Q99714 5/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
POLB P06746 1/20 0.45
ADRB2 P07550 3/20 0.44
ME2 P23368 1/20 0.43
ME1 P48163 1/20 0.43
ME3 Q16798 1/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 1/20 0.42
CASP1 P29466 1/20 0.42
HSP90AA1 P07900 1/20 0.42
HSP90AB1 P08238 1/20 0.42
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
RECQL P46063 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
SCHEMBL6507412 0.93 KDM4E (0.49) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL6531802 0.86 ADRB2 (0.49) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL3913912 0.85 ADRB2 (0.47) KDM4ESMN1; SMN2POLBADRB2KMT2A
SCHEMBL3992464 0.85 ADRB2 (0.49) KDM4ESMN1; SMN2POLBADRB2KMT2A
SCHEMBL3913331 0.85 ADRB2 (0.47) KDM4ESMN1; SMN2POLBADRB2KMT2A
SCHEMBL3913917 0.85 ADRB2 (0.49) KDM4ESMN1; SMN2POLBADRB2KMT2A
SCHEMBL3924705 0.84 ADRB2 (0.52) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL13840821 0.84 ADRB2 (0.52) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL6482712 0.84 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL3918574 0.84 ADRB2 (0.46) KDM4ESMN1; SMN2POLBADRB2KMT2A

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
EP-1730141-B1 COMPOUNDS FOR THE TREATMENT OF DISEASES PFIZER LTD (GB) 2009-05-27 EP claimed
EP-1730141-A1 COMPOUNDS FOR THE TREATMENT OF DISEASES Pfizer Limited (GB) 2006-12-13 EP claimed
WO-2005092887-A1 COMPOUNDS FOR THE TREATMENT OF DISEASES PFIZER LIMITED (GB) 2005-10-06 WO claimed
EP-1730141-B1 COMPOUNDS FOR THE TREATMENT OF DISEASES PFIZER LTD (GB) 2009-05-27 EP disclosed
US-7538141-B2 Compounds for the treatment of diseases PFIZER INC. 2009-05-26 US disclosed
EP-1730141-A1 COMPOUNDS FOR THE TREATMENT OF DISEASES Pfizer Limited (GB) 2006-12-13 EP disclosed
US-20050222128-A1 Compounds for the treatment of diseases PFIZER INC 2005-10-06 US disclosed
WO-2005092887-A1 COMPOUNDS FOR THE TREATMENT OF DISEASES PFIZER LIMITED (GB) 2005-10-06 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-20050222128-A1 Compounds for the treatment of diseases LTC4S, LTB4R2, CYP11B2 KDM4E 4224/4885ALDH1A1 128/4885HPGD 53/4885

“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.