SCHEMBL7863317

SCHEMBL7863317

Nc1ccc(-c2ccc(-c3ccc(N)cc3)c(C(F)(F)F)c2C(F)(F)F)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.54
TSHR P16473 2/20 0.46
GLA P06280 1/20 0.46
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
TDP1 Q9NUW8 4/20 0.46
CYP3A4 P08684 4/20 0.46
ALDH1A1 P00352 3/20 0.46
TP53 P04637 1/20 0.46
USP7 Q93009 1/20 0.40
TAAR1 Q96RJ0 2/20 0.39
PDK2 Q15119 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.38
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
APP P05067 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
SCHEMBL1334217 0.92 KIF11 (0.47) KIF11TSHRGLAPOLBGAA
SCHEMBL29620302 0.92 KIF11 (0.47) KIF11TSHRGLAPOLBGAA
SCHEMBL25241146 0.84 KIF11 (0.40) KIF11TSHRGLAPOLBGAA
SCHEMBL29033371 0.84 KIF11 (0.40) KIF11TSHRGLAPOLBGAA
SCHEMBL3790566 0.81 KIF11 (0.45) KIF11TSHRGLAPOLBGAA
SCHEMBL28676641 0.80 KIF11 (0.44) KIF11TSHRGLAPOLBGAA
SCHEMBL30972581 0.78 HSD17B10 (0.44) KIF11TSHRGLAPOLBGAA
SCHEMBL13385838 0.78 KIF11 (0.47) KIF11TSHRGLAPOLBGAA
SCHEMBL13385864 0.77 KIF11 (0.46) KIF11TSHRGLAPOLBGAA
SCHEMBL1011735 0.76 GAA (0.76) KIF11TSHRGLAPOLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5310863-A Polyimide materials with improved physico-chemical properties INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1994-05-10 US claimed
US-6303743-B1 Polyimide for optical communications, method of preparing the same, and method of forming multiple polyimide film using the polyimide SAMSUNG ELECTRONICS CO., LTD. (KR) 2001-10-16 US disclosed
US-6077928-A Bis(dialkylmaleimide) derivative and polyetherimide for optical communications formed therefrom SAMSUNG ELECTRONICS CO., LTD. (KR) 2000-06-20 US disclosed
US-6031061-A Bis (triaklyltrimellitic anhydride) derivative and polyesterimide for optical communications formed therefrom SAMSUNG ELECTRONICS CO., LTD. (KR) 2000-02-29 US disclosed
US-6028159-A Polyamideimide for optical communications and method for preparing the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2000-02-22 US disclosed
US-5310863-A Polyimide materials with improved physico-chemical properties INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1994-05-10 US disclosed