SCHEMBL9260624

SCHEMBL9260624

CCC(=O)N(c1ccc(N(C(=O)CC)C2CCCCC2)cc1)C1CCCCC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ NPC1 O15118 1/20 0.59
▸ MITF O75030 1/20 0.59
▸ ALDH1A1 P00352 1/20 0.59
▸ RAB9A P51151 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ PAX8 Q06710 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ OPRM1 P35372 8/20 0.54
▸ SIGMAR1 Q99720 2/20 0.54
▸ OPRL1 P41146 1/20 0.52
▸ OPRD1 P41143 3/20 0.51
▸ SLC22A1 O15245 1/20 0.51
▸ NR1I2 O75469 1/20 0.51
▸ ABCB1 P08183 1/20 0.51
▸ CHRM1 P11229 1/20 0.51
▸ DRD2 P14416 1/20 0.51
▸ ADRA2B P18089 1/20 0.51
▸ ADRA2C P18825 1/20 0.51

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
SCHEMBL18569422 0.92 KDM4E (0.72) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL9845445 0.92 MEN1 (0.51) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL11436717 0.90 MEN1 (0.52) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL9346956 0.86 ALDH1A1 (0.47) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL926471 0.77 SLC6A4 (0.51) OPRM1SIGMAR1OPRL1OPRD1SLC22A1
SCHEMBL6003176 0.77 MEN1 (0.47) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL5992122 0.76 MITF (0.74) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL7905910 0.76 MITF (0.74) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL2094921 0.76 MEN1 (0.52) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL8913127 0.76 OPRM1 (0.61) KDM4EMEN1NPC1MITFALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5384425-A Diurea derivatives useful as medicaments and processes for the preparation thereof YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1995-01-24 — — US disclosed
EP-0325397-B1 DIUREA DERIVATIVES USEFUL AS MEDICAMENTS AND PROCESSES FOR THE PREPARATION THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1993-08-18 — — EP disclosed
US-5227492-A Anticholesterol agents YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1993-07-13 — — US disclosed
US-5166429-A Enzyme inhibitors of acylcoenzyme A cholesterol transferase as anticholesterol agents or antideposit agents YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1992-11-24 — — US disclosed
US-5091419-A Anticholesterol agent YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1992-02-25 — — US disclosed
EP-0325397-A1 Diurea derivatives useful as medicaments and processes for the preparation thereof YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1989-07-26 — — EP disclosed
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