SCHEMBL1844486

SCHEMBL1844486

CCC(C)Nc1ccc(-c2ccc(NC(C)CC)cc2)cc1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.86
CYP3A4 P08684 4/20 0.86
L3MBTL1 Q9Y468 4/20 0.86
ALOX15 P16050 3/20 0.86
TSHR P16473 3/20 0.86
HSD17B10 Q99714 3/20 0.86
TDP1 Q9NUW8 3/20 0.86
HIF1A Q16665 2/20 0.86
TP53 P04637 2/20 0.86
THRB P10828 2/20 0.86
HSP90AA1 P07900 1/20 0.86
CASP1 P29466 1/20 0.86
SMN1; SMN2 Q16637 1/20 0.86
ALOX12 P18054 2/20 0.42
MAPK1 P28482 2/20 0.42
PTPN1 P18031 1/20 0.39
RAB9A P51151 1/20 0.38
HCAR3 P49019 1/20 0.37
LMNA P02545 1/20 0.35
RECQL P46063 1/20 0.35

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
Methane SCHEMBL21294035 0.98 ALDH1A1 (0.82) ALDH1A1CYP3A4L3MBTL1ALOX15TSHR
SCHEMBL49805 0.93 ALDH1A1 (1.00) ALDH1A1CYP3A4L3MBTL1ALOX15TSHR
SCHEMBL21704895 0.92 ALDH1A1 (0.72) ALDH1A1CYP3A4L3MBTL1ALOX15TSHR
SCHEMBL20146569 0.92 ALDH1A1 (0.72) ALDH1A1CYP3A4L3MBTL1ALOX15TSHR
SCHEMBL11482583 0.86 ALDH1A1 (0.86) ALDH1A1CYP3A4L3MBTL1ALOX15TSHR
SCHEMBL9572276 0.86 ALDH1A1 (0.86) ALDH1A1CYP3A4L3MBTL1ALOX15TSHR
SCHEMBL9874686 0.86 ALDH1A1 (0.86) ALDH1A1CYP3A4L3MBTL1ALOX15TSHR
SCHEMBL11466441 0.84 ALDH1A1 (0.82) ALDH1A1CYP3A4L3MBTL1ALOX15TSHR
SCHEMBL8559868 0.84 ALDH1A1 (0.82) ALDH1A1CYP3A4L3MBTL1ALOX15TSHR
SCHEMBL10396526 0.82 ALDH1A1 (0.64) ALDH1A1CYP3A4L3MBTL1ALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4731701-A1 METHOD FOR PREPARING A POLYOXYALKYLENE POLYOL Covestro Deutschland AG (DE) 2026-04-29 EP disclosed
EP-4644451-A1 COMPOUND CONTAINING AROMATIC HYDROXYL GROUPS AND PROCESS FOR PRODUCING THE SAME Covestro Deutschland AG (DE) 2025-11-05 EP disclosed
EP-4413056-B1 METHOD FOR PRODUCING POLYOXYALKYLENE POLYESTERPOLYOLS COVESTRO DEUTSCHLAND AG (DE) 2025-07-23 EP disclosed
EP-4574869-A1 COMPOUND CONTAINING OXIME HYDROXYL GROUPS AND METHOD OF MAKING THE SAME Covestro Deutschland AG (DE) 2025-06-25 EP disclosed
US-12227614-B2 Process for preparing polyoxyalkylene polyester polyols COVESTRO DEUTSCHLAND AG (DE) 2025-02-18 US disclosed
US-20250019486-A1 PROCESS FOR PREPARING POLYOXYALKYLENE POLYESTER POLYOLS COVESTRO DEUTSCHLAND AG (DE) 2025-01-16 US disclosed
WO-2024260924-A1 METHOD FOR PREPARING A POLYOXYALKYLENE POLYOL COVESTRO DEUTSCHLAND AG (DE) 2024-12-26 WO disclosed
EP-4480993-A1 METHOD FOR PRODUCING POLYOXYALKYLENE POLYOL Covestro Deutschland AG (DE) 2024-12-25 EP disclosed
US-12091543-B2 Process for producing polyoxyalkylene-polyol mixtures COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2024-09-17 US disclosed
EP-4413056-A1 PROCESS FOR PREPARING POLYOXYALKYLENE POLYESTER POLYOLS Covestro Deutschland AG (DE) 2024-08-14 EP disclosed
US-5059632-A NOVEL COPOLYMERS AND THEIR USE AS AUXILIARIES AND/OR ADDITIVES IN FORMULATIONS FOR THE PREPARATION OF POLYISOCYANATE ADDITION POLYMERIZATION PRODUCTS BASF AKTIENGESELLSCHAFT (DE) 1991-10-22 US disclosed
US-5051310-A Textured polyurethane molded articles having multiple sheet layers BASF AKTIENGESELLSCHAFT (DE) 1991-09-24 US disclosed
US-4972002-A Process for producing cellular plastics by the polyisocyanate polyaddition method by means of stable emulsions containing blowing agents, and such emulsions BASF AKTIENGESELLSCHAFT (DE) 1990-11-20 US disclosed
US-4798851-A POLYESTERPOLYOL BASF AKTIENGESELLSCHAFT (DE) 1989-01-17 US disclosed
US-4778830-A POLY(UREA)URETHANE ELASTOMER BASF AKTIENGESELLSCHAFT (DE) 1988-10-18 US disclosed
US-4731392-A Process for the preparation of polyester polyols, based on 2-methyl-1,4-butanediol, which are liquid at room temperature, and their use for the preparation of plastic materials BASF AKTIENGESELLSCHAFT (DE) 1988-03-15 US disclosed
US-4636531-A REACTION INJECTION MOLDING, CHAIN EXTENSION, STERIC HINDRANCE, PRIMARY AROMATIC DIAMINE BASF AKTIENGESELLSCHAFT (DE) 1987-01-13 US disclosed
US-4595705-A Using as polyol 95 to 60 percent conventional polyol and 5 to 40 percent aromatic polyester polyol BASF AKTIENGESELLSCHAFT (DE) 1986-06-17 US disclosed
US-4581387-A REACTION PRODUCT OF MONTANIC ACID AND TEN OR MORE CARBON ATOMS CARBOXYLIC ACID AND POLYOL, ALKANOLAMINE, OR POLYAMINE BASF AKTIENGESELLSCHAFT (DE) 1986-04-08 US disclosed
US-4581432-A POLYURETHANE, POLYURETH, POLYISOCYANURATE MOLDING MATERIALS, DEACTIVATION BASF AKTIENGESELLSCHAFT (DE) 1986-04-08 US disclosed