SCHEMBL7083846

SCHEMBL7083846

NCc1ccc(Cl)nc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 3/20 0.41
PDCD1LG2 Q9BQ51 2/20 0.41
PNMT P11086 2/20 0.39
NOTUM Q6P988 1/20 0.36
DPP4 P27487 2/20 0.34
LOXL2 Q9Y4K0 2/20 0.34
LOX P28300 1/20 0.34
LOXL3 P58215 1/20 0.34
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
PDCD1 Q15116 1/20 0.33
KMT2A Q03164 1/20 0.31
IDO1 P14902 1/20 0.31
AOC1 P19801 2/20 0.31
AOC3 Q16853 2/20 0.31
CRHBP P24387 1/20 0.30
CRHR2 Q13324 1/20 0.30
PIK3CD O00329 1/20 0.30
TUBB4A P04350 1/20 0.30
TUBB P07437 1/20 0.30

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
SCHEMBL378832 0.78 KMT2A (0.45) KMT2ACRHBPCRHR2TUBB4ATUBB
SCHEMBL10939643 0.77 POLB (0.37) CD274PDCD1LG2PNMTNOTUMDPP4
SCHEMBL584007 0.77 CD274 (0.39) CD274PDCD1LG2PNMTNOTUMDPP4
SCHEMBL30968506 0.76 KDM4E (0.40) NOTUMKMT2ACRHBPCRHR2TUBB4A
SCHEMBL844810 0.76 KDM4E (0.40) NOTUMKMT2ACRHBPCRHR2TUBB4A
SCHEMBL13066848 0.76 IDO1 (0.41) KMT2AIDO1CRHBPCRHR2TUBB4A
SCHEMBL5745630 0.76 CTRC (0.39) CD274PDCD1LG2GABRA1GABRB2KMT2A
Hydrochloric Acid SCHEMBL5214006 0.76 KMT2A (0.44) KMT2ACRHBPCRHR2TUBB4ATUBB
SCHEMBL844505 0.76 KMT2A (0.31) KMT2ACRHBPCRHR2TUBB4ATUBB
Hydrochloric Acid SCHEMBL5013615 0.76 POLB (0.36) CD274PDCD1LG2PNMTNOTUMDPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1200430-A4 THIOUREA AND ISOTHIOUREA DERIVATIVES FOR INHIBITING RAS-TRANSFORMED CELL GROWTH YUHAN CORP LTD (KR) 2003-01-22 EP disclosed
US-6407248-B1 INSECTICIDES, MITICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-06-18 US disclosed
EP-1200430-A1 THIOUREA AND ISOTHIOUREA DERIVATIVES FOR INHIBITING RAS-TRANSFORMED CELL GROWTH YUHAN CORPORATION, LTD. (KR) 2002-05-02 EP disclosed
EP-0509559-B1 Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-10-04 EP disclosed
WO-2001009128-A1 THIOUREA AND ISOTHIOUREA DERIVATIVES FOR INHIBITING RAS-TRANSFORMED CELL GROWTH YUHAN CORPORATION (KR) 2001-02-08 WO disclosed
US-6124297-A COMBATTING INSECTS OR MITES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-09-26 US disclosed
US-5935981-A INSECTICIDAL/MITICIDAL ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-08-10 US disclosed
US-5849768-A α-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-12-15 US disclosed
EP-0529680-B1 Intermediates, their production and their use for preparing alpha-unsaturated amines TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-05-13 EP disclosed
EP-0302389-B1 Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1993-12-22 EP disclosed
US-5214152-A Insecticides, miticides TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-05-25 US disclosed
EP-0529680-A2 Intermediates, their production and their use for preparing alpha-unsaturated amines TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-03-03 EP disclosed
US-5175301-A Insecticide, miticide, pesticide TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-29 US disclosed
EP-0509559-A2 Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-10-21 EP disclosed
EP-0302389-A2 Alpha-unsaturated amines, their production and use Takeda Chemical Industries, Ltd. (JP) 1989-02-08 EP disclosed
US-4242516-A Fluorinated amphoteric surfactants CIBA-GEIGY CORPORATION (US) 1980-12-30 US disclosed
US-4161590-A Fluorinated amphoteric and cationic surfactants CIBA-GEIGY CORPORATION (US) 1979-07-17 US disclosed
US-4161602-A Fluorinated amphoteric and cationic surfactants containing a pyridinium moiety CIBA-GEIGY CORPORATION (US) 1979-07-17 US disclosed
US-4069244-A THIO-CARBOXYLIC ACIDS CIBA-GEIGY CORPORATION (US) 1978-01-17 US disclosed