SCHEMBL8028832

SCHEMBL8028832

C#Cc1ccc(N(CC)CCO)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.42
MAPT P10636 5/20 0.42
RAB9A P51151 5/20 0.42
NPC1 O15118 4/20 0.42
PSMD14 O00487 2/20 0.42
MITF O75030 1/20 0.42
ALDH1A1 P00352 8/20 0.38
RECQL P46063 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
TSHR P16473 2/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38
GFER P55789 1/20 0.38
MEN1 O00255 5/20 0.37
KDM4E B2RXH2 4/20 0.37
GAA P10253 4/20 0.37
THRB P10828 1/20 0.37
GHSR Q92847 1/20 0.37
ALDH3A1 P30838 1/20 0.36

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
SCHEMBL3100616 0.89 MAPT (0.39) KMT2AMAPTRAB9ANPC1PSMD14
SCHEMBL16983221 0.85 KMT2A (0.43) KMT2AMAPTRAB9ANPC1PSMD14
SCHEMBL1099561 0.85 ALDH1A1 (0.52) KMT2AMAPTRAB9ANPC1PSMD14
SCHEMBL8038944 0.84 ALDH1A1 (0.50) KMT2AMAPTRAB9ANPC1PSMD14
SCHEMBL8039657 0.82 ALDH1A1 (0.54) KMT2AMAPTRAB9ANPC1PSMD14
Hydrochloric Acid SCHEMBL8040784 0.82 KMT2A (0.49) KMT2AMAPTRAB9ANPC1PSMD14
SCHEMBL7466596 0.82 MAPT (0.45) KMT2AMAPTRAB9ANPC1PSMD14
SCHEMBL10189317 0.81 ALDH1A1 (0.41) KMT2AMAPTRAB9ANPC1PSMD14
Hydrochloric Acid SCHEMBL8042521 0.81 ALDH1A1 (0.52) KMT2AMAPTRAB9ANPC1PSMD14
SCHEMBL5136014 0.79 CNR2 (0.43) TDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5672760-A OBTAINING A PHOTOABSORBER-CONTAINING ACRYLIC POLYMER BY USING N-2-HYDROXYETHYL-N-ETHYL ANILINE TO OBTAIN 4-((2-HYDROXYETHYL)ETHYLAMINO)-4'-(TRIFLUOROMETHYLSULFONYL)-TOLANE WHICH REACTS WITH A POLYMERIZABLE METHACRYLIC ACID INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1997-09-30 US claimed
US-6156445-A A METALLIZED CERAMIC SUBSTRATE COATED A FILM OF AN ABLATIVELY PHOTODECOMPOSABLE ACRYLATE POLYMER MODIFIED BY DISPERSE RED 1, A PHOTOABSORBER; CIRCUIT PATTERNS; NO PHASE SEPARATION OR CRYSTALLIZATION, EVEN ABLATION AND HIGH RESOLUTION INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2000-12-05 US disclosed
US-5919868-A ACRYLATE MONOMERIC UNITS AND A PHOTOABSORBER BOUND TO THE MONOMERIC UNITS WHICH IS: 1-(DIMETHYLAMINO)-PYRENE, 4-(12-HYDROXYETHYL)ETHYLAMINO)-4-(TRIFLUOROMETHYLSULFONYL)TOLA NE, OR 7-HYDROXY-4-METHYL-2H-1-BENZOPYRENE-2-ONE. INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1999-07-06 US disclosed
US-5902712-A SUBSTRATE HAVING CIRCUITS DISPOSED THEREON, COATED WITH ABLATIVELY PHOTODECOMPOSABLE POLYMER COMPRISING ACRYLIC POLYMER WITH BOUND PHOTOABSORBER INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1999-05-11 US disclosed
US-5756259-A WITH POLYMER HAVING BOUND PHOTOABSORBER INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1998-05-26 US disclosed
US-5705570-A ACRYLATE POLYMERS INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1998-01-06 US disclosed
US-5672760-A OBTAINING A PHOTOABSORBER-CONTAINING ACRYLIC POLYMER BY USING N-2-HYDROXYETHYL-N-ETHYL ANILINE TO OBTAIN 4-((2-HYDROXYETHYL)ETHYLAMINO)-4'-(TRIFLUOROMETHYLSULFONYL)-TOLANE WHICH REACTS WITH A POLYMERIZABLE METHACRYLIC ACID INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1997-09-30 US disclosed