SCHEMBL7899796

SCHEMBL7899796

CC(C)CCCCCCCCCCN=C(NC1CCCCC1)NC1CCCCC1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.69
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
EPHX1 P07099 5/20 0.41
HTT P42858 1/20 0.38
ATM Q13315 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
EPHX2 P34913 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
SCHEMBL8015624 0.85 SIGMAR1 (0.50) SIGMAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL9543409 0.82 SIGMAR1 (1.00) SIGMAR1EPHX1EPHX2
SCHEMBL19447867 0.82 SIGMAR1 (1.00) SIGMAR1EPHX1EPHX2
SCHEMBL2740860 0.82 SIGMAR1 (1.00) SIGMAR1EPHX1EPHX2
SCHEMBL7654570 0.82 SIGMAR1 (1.00) SIGMAR1EPHX1EPHX2
SCHEMBL45893 0.78 SIGMAR1 (0.87) SIGMAR1ALDH1A1EPHX1EPHX2
SCHEMBL14373127 0.74 SIGMAR1 (0.74) SIGMAR1ALDH1A1EPHX1EPHX2
SCHEMBL27434312 0.71 ALDH1A1 (0.49) ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL16499598 0.71 SIGMAR1 (0.59) SIGMAR1ALDH1A1SMN1; SMN2EPHX1NPSR1
SCHEMBL2740904 0.70 SIGMAR1 (0.58) SIGMAR1ALDH1A1CYP3A4SMN1; SMN2EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5968364-A EXTRACTION OF TOXIC MATERIALS FROM METALLURGICAL FROTH FLOTATION WASTE WATER USING A HYDROCARBYL GUANIDINE EXTRACTANT CAPABLE OF BEING PROTONATED AT ALKALINE PH HENKEL CORPORATION (US) 1999-10-19 US claimed
US-5939034-A Process for the recovery of precious metal values from aqueous ammoniacal thiosulfate leach solutions HENKEL CORPORATION (US) 1999-08-17 US claimed
EP-2998285-B1 EXTRACTION OF CARBOXYLIC ACIDS FROM A DILUTE AQUEOUS STREAM PURAC BIOCHEM BV (NL) 2021-09-15 EP disclosed
EP-2804846-B1 EXTRACTION OF CARBOXYLIC ACIDS FROM A DILUTE AQUEOUS STREAM PURAC BIOCHEM BV (NL) 2016-03-30 EP disclosed
EP-2998285-A1 EXTRACTION OF CARBOXYLIC ACIDS FROM A DILUTE AQUEOUS STREAM PURAC Biochem BV (NL) 2016-03-23 EP disclosed
US-9102611-B2 Extraction of carboxylic acids from a dilute aqueous stream PURAC BIOCHEM B.V. (NL) 2015-08-11 US disclosed
EP-2804846-A1 EXTRACTION OF CARBOXYLIC ACIDS FROM A DILUTE AQUEOUS STREAM Purac Biochem bv (NL) 2014-11-26 EP disclosed
US-20140343317-A1 EXTRACTION OF CARBOXYLIC ACIDS FROM A DILUTE AQUEOUS STREAM PURAC BIOCHEM B.V. (NL) 2014-11-20 US disclosed
WO-2013109143-A1 EXTRACTION OF CARBOXYLIC ACIDS FROM A DILUTE AQUEOUS STREAM STICHTING PUBLIC PRIVATE PARTNERSHIP INSTITUTE FOR SUSTAINABLE PROCESS TECHNOLOGY (NL) 2013-07-25 WO disclosed
US-6197214-B1 RECOVERY OF PRECIOUS METALS, E.G. GOLD, SILVER, FROM AQUEOUS AMMONIUM THIOSULFATE LEACH SOLUTIONS BY EXTRACTION WITH AN ION EXCHANGE RESINS HAVNG GUANIDINE AND/OR QUATERNARY AMINE GROUPS HENKEL CORPORATION 2001-03-06 US disclosed
US-5968364-A EXTRACTION OF TOXIC MATERIALS FROM METALLURGICAL FROTH FLOTATION WASTE WATER USING A HYDROCARBYL GUANIDINE EXTRACTANT CAPABLE OF BEING PROTONATED AT ALKALINE PH HENKEL CORPORATION (US) 1999-10-19 US disclosed
US-5939034-A Process for the recovery of precious metal values from aqueous ammoniacal thiosulfate leach solutions HENKEL CORPORATION (US) 1999-08-17 US disclosed
US-5522997-A REMOVAL OF TOXIC CYANIDE METALS FORM AN ALKALINE SOLUTION RESULTING FROM MININING AND PLATING INDUSTRIES BY CONTACTING WITH A EXTRACTANT WHICH IS CAPABLE OF BEING PROTONATED AT PH 9 OR ABOVE COGNIS, INC. (US) 1996-06-04 US disclosed
WO-1994021345-A1 REMOVING TOXIC METALS FROM SOLUTIONS COGNIS, INC. (US) 1994-09-29 WO disclosed