SCHEMBL7368280

SCHEMBL7368280

NCCCNN1CCCC1=O

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
BRD4 O60885 1/20 0.33
BRD2 P25440 1/20 0.33
LMNA P02545 2/20 0.32
KMT2A Q03164 1/20 0.32
PIK3CD O00329 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA3 P07451 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA13 Q8N1Q1 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA5B Q9Y2D0 1/20 0.31

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
SCHEMBL6645161 0.81 BRD4 (0.35) TSHRBRD4BRD2LMNAKMT2A
SCHEMBL11209111 0.79 ALOX5 (0.41) BRD4BRD2
SCHEMBL22163800 0.77 LMNA (0.38) TSHRBRD4BRD2LMNAKMT2A
SCHEMBL1306308 0.77 BRD4 (0.40) TSHRBRD4BRD2LMNAKMT2A
SCHEMBL7098874 0.75 ALDH1A1 (0.34) LMNAKMT2A
SCHEMBL9258846 0.74 SMN1; SMN2 (0.35)
SCHEMBL9264820 0.72
SCHEMBL2892590 0.69 LMNA (0.47) TSHRLMNAKMT2A
SCHEMBL22869254 0.69
SCHEMBL56994 0.67 TSHR (0.50) TSHRBRD4BRD2KMT2APIK3CD

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
EP-1242120-A2 COMBINATIONS OF GROWTH FACTORS AND I:UPA OR I:MMP FOR THE TREATMENT OF DAMAGED TISSUE Pfizer Limited (GB) 2002-09-25 EP disclosed
WO-2001049309-A2 COMBINATIONS OF GROWTH FACTORS AND I: UPA OR I: MMP FOR THE TREATMENT OF DAMAGED TISSUE PFIZER LIMITED (GB) 2001-07-12 WO disclosed
US-6117841-A USED TO TREAT STROKE, CEREBRAL ISCHEMIA, PAIN, HEAD TRAUMA OR EPILEPSY WARNER-LAMBERT COMPANY (US) 2000-09-12 US disclosed
WO-1998054123-A1 SUBSTITUTED PEPTIDYLAMINE CALCIUM CHANNEL BLOCKERS WARNER-LAMBERT COMPANY (US) 1998-12-03 WO disclosed