SCHEMBL10522334

SCHEMBL10522334

CN1CCN(C(=O)c2cccc(N)c2N)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.56
HRH4 Q9H3N8 4/20 0.53
KMT2A Q03164 3/20 0.52
LMNA P02545 2/20 0.48
TP53 P04637 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
POLB P06746 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
CHEK1 O14757 1/20 0.45
HTT P42858 1/20 0.45
KDM4E B2RXH2 1/20 0.45
RAB9A P51151 1/20 0.45

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
SCHEMBL2033421 0.87 L3MBTL1 (0.64) L3MBTL1HRH4KMT2ALMNATP53
SCHEMBL3881407 0.86 L3MBTL1 (0.55) L3MBTL1HRH4KMT2ALMNATP53
SCHEMBL2378330 0.86 L3MBTL1 (0.55) L3MBTL1HRH4KMT2ALMNATP53
SCHEMBL10520056 0.83 HSD11B1 (0.46) HRH4KMT2AALDH1A1CA12CA1
SCHEMBL519919 0.82 ALDH1A1 (0.53) L3MBTL1HRH4KMT2ALMNAPOLB
SCHEMBL10722273 0.81 L3MBTL1 (0.74) L3MBTL1KMT2ALMNATP53ALOX15
SCHEMBL10578175 0.81 SMN1; SMN2 (0.55) KMT2ATP53TSHRALDH1A1HPGD
SCHEMBL9539394 0.81 RXFP1 (0.58) HRH4CA12CA1CA2CA7
SCHEMBL31172456 0.81 SMN1; SMN2 (0.55) KMT2ATP53TSHRALDH1A1HPGD
SCHEMBL10518702 0.81 HSD17B10 (0.53) KMT2ALMNAALOX15TSHRPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300366-A1 Non-fugitive aromatic diamine catalytic chain extenders AIR PRODUCTS AND CHEMICALS, INC. (US) 1989-01-25 EP claimed