SCHEMBL11587705

SCHEMBL11587705

Nc1ccc(-c2nnc(-c3ccc(N)cc3)[nH]2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
CYP3A4 P08684 4/20 0.50
TP53 P04637 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
MEN1 O00255 8/20 0.48
KMT2A Q03164 8/20 0.48
NPC1 O15118 7/20 0.48
RAB9A P51151 7/20 0.48
MAPT P10636 6/20 0.48
KDM4E B2RXH2 5/20 0.48
HSD17B10 Q99714 5/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
HPGD P15428 4/20 0.48
GFER P55789 3/20 0.48
GLA P06280 3/20 0.48
POLB P06746 3/20 0.48
GAA P10253 3/20 0.48
RECQL P46063 2/20 0.48
RXFP1 Q9HBX9 2/20 0.48
BLM P54132 2/20 0.46

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
SCHEMBL17982956 0.84 ALDH1A1 (0.45) ALDH1A1CYP3A4TP53TDP1MEN1
SCHEMBL7119605 0.84 RPS6KA3 (0.45) ALDH1A1CYP3A4TP53TDP1MEN1
SCHEMBL20812633 0.84 KDM4E (0.50) ALDH1A1CYP3A4TP53TDP1MEN1
SCHEMBL16599396 0.80 KIF11 (0.44) ALDH1A1CYP3A4TP53TDP1MEN1
SCHEMBL38659101 0.78 KIF11 (0.47) ALDH1A1CYP3A4TP53TDP1MEN1
SCHEMBL17978577 0.75 SMN1; SMN2 (0.44) ALDH1A1CYP3A4TP53TDP1MEN1
Hydrochloric Acid SCHEMBL18011222 0.75 ALDH1A1 (0.42) ALDH1A1CYP3A4TP53TDP1MEN1
SCHEMBL20401786 0.74 MAPK13 (0.46) ALDH1A1TP53MAPTMAPK1MMP2
SCHEMBL13526112 0.74 MAPT (0.52) ALDH1A1CYP3A4TP53MEN1KMT2A
SCHEMBL12311604 0.74 NISCH (0.50) CYP3A4TDP1MEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2709667-B1 BIO-ORTHOGONAL DRUG ACTIVATION TAGWORKS PHARMACEUTICALS B V (NL) 2022-04-13 EP disclosed
US-11034797-B2 Polyimide precursor composition, use thereof and polyimide made therefrom ETERNAL MATERIALS CO., LTD. (TW) 2021-06-15 US disclosed
US-20210079161-A1 POLYIMIDE PRECURSOR COMPOSITION, USE THEREOF AND POLYIMIDE MADE THEREFROM ETERNAL MATERIALS CO., LTD. (TW) 2021-03-18 US disclosed
EP-3173401-A1 PROCESS FOR THE SYNTHESIS OF ARYLDIAZONIUM SALTS USING NITROGEN OXIDES IN OXYGEN-CONTAINING GAS STREAMS, ESPECIALLY FROM INDUSTRIAL WASTE GASES Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2017-05-31 EP disclosed
US-4120861-A PLANT GROWTH REGULATORS UNIROYAL, INC. (US) 1978-10-17 US disclosed
US-4102682-A Imaging member XEROX CORPORATION (US) 1978-07-25 US disclosed
US-RE29554-E Organic photoconductive members comprising dicyanomethylene substituted fluorene sensitizers ADDRESSOGRAPH-MULTIGRAPH CORPORATION (US) 1978-02-28 US disclosed
US-4072517-A Migration imaging method XEROX CORPORATION (US) 1978-02-07 US disclosed
US-4035175-A SOYBEANS, COTTON UNIROYAL INC. (US) 1977-07-12 US disclosed
US-4013462-A Migration imaging system XEROX CORPORATION (US) 1977-03-22 US disclosed
US-3947263-A OXADIAZOLE OR THIADIAZOLE SUBSTITUTED BENZOIC ACID UNIROYAL, INC. (US) 1976-03-30 US disclosed
US-3933491-A Imaging system XEROX CORPORATION (US) 1976-01-20 US disclosed