SCHEMBL3400985

SCHEMBL3400985

CCCCCNc1cc(NCCCCC)cc(NCCCCC)c1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.53
ABL1 P00519 1/20 0.52
GPR84 Q9NQS5 10/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
KCNH3 Q9ULD8 2/20 0.44
DNM2 P50570 3/20 0.42
EPHX1 P07099 1/20 0.42

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
SCHEMBL28700733 0.97 ABL1 (0.55) ADRA2AABL1GPR84ALDH1A1TSHR
SCHEMBL18386504 0.89 ADRA2A (0.50) ADRA2AABL1GPR84ALDH1A1DNM2
SCHEMBL8958338 0.86 THRB (0.52) ADRA2AABL1GPR84ALDH1A1KCNH3
SCHEMBL3662823 0.86 ABL1 (0.54) ADRA2AABL1ALDH1A1KCNH3EPHX1
SCHEMBL6233796 0.86 KCNH3 (0.47) ADRA2AABL1GPR84ALDH1A1TSHR
SCHEMBL10381587 0.84 ADRA2A (0.50) ADRA2AABL1GPR84ALDH1A1DNM2
SCHEMBL7998280 0.84 ADRA2A (0.50) ADRA2AABL1GPR84ALDH1A1DNM2
SCHEMBL9187399 0.84 GPR84 (0.51) ADRA2AABL1GPR84KCNH3
SCHEMBL5605010 0.84 ADRA2A (0.50) ADRA2AABL1GPR84ALDH1A1DNM2
SCHEMBL27893435 0.84 ADRA2A (0.50) ADRA2AABL1GPR84ALDH1A1DNM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1496044-B1 NOVEL 1,3,5-TRIS(ARYLAMINO)BENZENE BANDO CHEMICAL IND (JP) 2010-11-03 EP claimed
US-7271291-B2 1,3,5-tris (arylamino) benzenes BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2007-09-18 US claimed
US-7196224-B2 1,3,5-tris(arylamino)benzenes BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2007-03-27 US claimed
US-20060173216-A1 Novel 1, 3, 5 tris (arylamino) benzenes BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2006-08-03 US claimed
US-20050090692-A1 Novel 1,3,5-tris(arylamino)benzene BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2005-04-28 US claimed
EP-1496044-A1 NOVEL 1,3,5-TRIS(ARYLAMINO)BENZENE Bando Chemical Industries, Ltd. (JP) 2005-01-12 EP claimed
CN-117865838-A Preparation method of N, N ', N ' ' -tripentyl-1, 3, 5-triaminobenzene 中国融通资源开发集团有限公司 2024-04-12 CN disclosed
JP-2010280635-A NOVEL 1,3,5-TRIS(ARYLAMINO)BENZENES AND USE THEREOF BANDO CHEM IND LTD 2010-12-16 JP disclosed
EP-1496044-B1 NOVEL 1,3,5-TRIS(ARYLAMINO)BENZENE BANDO CHEMICAL IND (JP) 2010-11-03 EP disclosed
EP-1496044-B1 NOVEL 1,3,5-TRIS(ARYLAMINO)BENZENE BANDO CHEMICAL IND (JP) 2010-11-03 EP disclosed
CN-100402489-C Novel 1,3, 5-tris (arylamino) benzenes BANDO CHEMICAL IND (JP) 2008-07-16 CN disclosed
US-7271291-B2 1,3,5-tris (arylamino) benzenes BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2007-09-18 US disclosed
US-7271291-B2 1,3,5-tris (arylamino) benzenes BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2007-09-18 US disclosed
US-20050090692-A1 Novel 1,3,5-tris(arylamino)benzene BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2005-04-28 US disclosed
EP-1496044-A1 NOVEL 1,3,5-TRIS(ARYLAMINO)BENZENE Bando Chemical Industries, Ltd. (JP) 2005-01-12 EP disclosed
EP-1496044-A1 NOVEL 1,3,5-TRIS(ARYLAMINO)BENZENE Bando Chemical Industries, Ltd. (JP) 2005-01-12 EP disclosed
JP-2004277385-A NEW 1,3,5-TRIS(ARYLAMINO)BENZENE BANDO CHEM IND LTD 2004-10-07 JP disclosed
WO-2004083161-A1 NOVEL 1,3,5-TRIS(ARYLAMINO)BENZENE BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2004-09-30 WO disclosed
JP-2004155754-A NEW 1,3,5-TRIS(ARYLAMINO)BENZENE COMPOUND BANDO CHEM IND LTD 2004-06-03 JP disclosed
WO-2003080558-A1 NOVEL 1,3,5-TRIS(ARYLAMINO)BENZENE BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2003-10-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060173216-A1 Novel 1, 3, 5 tris (arylamino) benzenes HSPA4L, HSPA1A, GAPVD1 ADRA2A 1361/4885ABL1 498/4885GPR84 4163/4885
US-20050090692-A1 Novel 1,3,5-tris(arylamino)benzene AHR, MYB, NAP1L4 ADRA2A 1196/4885ABL1 294/4885GPR84 2849/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.