SCHEMBL532599

SCHEMBL532599

O=C=NC1(C(N=C=O)(N=C=O)C2CCCCC2)CCCCC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL10506056 0.76
SCHEMBL9960504 0.74
SCHEMBL6818092 0.72 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9768725 0.72
SCHEMBL9016985 0.68
SCHEMBL455392 0.67
SCHEMBL29220071 0.66 ALDH1A1 (0.42) ALDH1A1
SCHEMBL33116 0.66 ALDH1A1 (0.42) ALDH1A1
SCHEMBL2895430 0.66 ALDH1A1 (0.42) ALDH1A1
SCHEMBL17375996 0.66 ALDH1A1 (0.42) ALDH1A1

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 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114829442-A Polyurea copolymers 巴斯夫欧洲公司 2022-07-29 CN claimed
CN-114829442-A Polyurea copolymers 巴斯夫欧洲公司 2022-07-29 CN disclosed
US-10870896-B2 Solid, particulate tanning agent preparations LANXESS DEUTSCHLAND GMBH (DE) 2020-12-22 US disclosed
EP-2694689-B1 SOLID PARICULATE MATERIAL BASED ON COMPOUNDS CONTAINING CARBAMOYLSULFONATE GROUPS LANXESS DEUTSCHLAND GMBH (DE) 2016-09-14 EP disclosed
EP-2694690-B1 SOLID, PARTICULATE TANNING AGENT PREPARATIONS LANXESS DEUTSCHLAND GMBH (DE) 2016-08-31 EP disclosed
US-9376729-B2 Compositions comprising at least one compound containing a carbamoyl sulfonate group and use of the same as tanning agents LANXESS DEUTSCHLAND GMBH (DE) 2016-06-28 US disclosed
EP-2601317-B1 COMPOSITIONS COMPRISING AT LEAST ONE COMPOUND CONTAINING A CARBAMOYL SULFONATE GROUP AND USE OF THE SAME AS TANNING AGENTS LANXESS DEUTSCHLAND GMBH (DE) 2014-12-17 EP disclosed
US-20140123399-A1 SOLID, PARTICULATE TANNING AGENT PREPARATIONS LANXESS DEUTSCHLAND GMBH (DE) 2014-05-08 US disclosed
EP-2694689-A1 SOLID, PARTICULATE MATERIAL BASED ON COMPOUNDS CONTAINING CARBAMOYLSULFONATE GROUPS LANXESS Deutschland GmbH (DE) 2014-02-12 EP disclosed
EP-2694690-A1 SOLID, PARTICULATE TANNING AGENT PREPARATIONS LANXESS Deutschland GmbH (DE) 2014-02-12 EP disclosed
US-5008436-A Filling, forming teeth BAYER AKTIENGESELLSCHAFT (DE) 1991-04-16 US disclosed
EP-0266589-B1 (METH)-ACRYLIC ACID DERIVATIVES FROM TRIISOCYANATES AND THEIR USE BAYER AG (DE) 1990-12-27 EP disclosed
EP-0400383-A1 Urea groups containing (meth)-acrylic acid derivativs from triisocyanates and their use BAYER AG (DE) 1990-12-05 EP disclosed
US-4902228-A (Meth)-acrylic acid derivatives of triisocyanates in dentistry BAYER AKTIENGESELLSCHAFT (DE) 1990-02-20 US disclosed
US-4868325-A (Meth)-acrylic acid derivatives of triisocyanates in dentistry BAYER AKTIENGESELLSCHAFT (DE) 1989-09-19 US disclosed
EP-0266589-A1 (Meth)-acrylic acid derivatives from triisocyanates and their use BAYER AG (DE) 1988-05-11 EP disclosed
EP-0162347-B1 CYCLOALIPHATIC TRIISOCYANATES, PROCESS FOR THEIR PRODUCTION, AND THEIR USE IN THE MANUFACTURE OF POLYURETHANES BAYER AG (DE) 1987-12-09 EP disclosed
US-4675437-A Cycloaliphatic triisocyanates BAYER AKTIENGESELLSCHAFT (DE) 1987-06-23 US disclosed
US-4603189-A Triisocyanates and a process for their preparation BAYER AKTIENGESELLSCHAFT (DE) 1986-07-29 US disclosed
EP-0162347-A1 Cycloaliphatic triisocyanates, process for their production, and their use in the manufacture of polyurethanes BAYER AG (DE) 1985-11-27 EP disclosed