SCHEMBL95298

SCHEMBL95298

CN(c1ccccc1)C(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HTT P42858 1/20 0.44
KCNN4 O15554 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
FAAH O00519 1/20 0.38
PHGDH O43175 1/20 0.38
MGLL Q99685 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
LMNA P02545 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NPSR1 Q6W5P4 2/20 0.35
RAB9A P51151 1/20 0.35
ALDH1A1 P00352 4/20 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
SCHEMBL126012 0.85 ALDH1A1 (0.44) MEN1KMT2ACYP3A4SMN1; SMN2ALDH1A1
SCHEMBL25137312 0.83 MEN1 (0.44) MEN1KMT2AHTTKCNN4CYP3A4
SCHEMBL11734333 0.80 ALDH1A1 (0.52) MEN1KMT2AHTTCYP3A4CYP2C9
SCHEMBL21120529 0.79 MEN1 (0.41) MEN1KMT2AHTTKCNN4CYP3A4
SCHEMBL13786373 0.77 KCNN4 (0.46) MEN1KMT2AHTTKCNN4CYP3A4
SCHEMBL10294024 0.76 ALDH1A1 (0.55) CYP2C19SMN1; SMN2CA12CA1CA2
SCHEMBL27989762 0.76 MEN1 (0.42) MEN1KMT2AHTTKCNN4CYP3A4
SCHEMBL4033878 0.76 MEN1 (0.42) MEN1KMT2AHTTKCNN4CYP3A4
SCHEMBL18364997 0.75 MEN1 (0.38) MEN1KMT2AHTTKCNN4CYP3A4
SCHEMBL17576276 0.75 MEN1 (0.38) MEN1KMT2AHTTKCNN4CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108441308-A Intermetallic composite coating water-soluble high-efficient micro emulsion cutting fluid 芜湖智为有道信息技术有限公司 2018-08-24 CN claimed
US-12037324-B2 Biarylmethyl heterocycles BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-16 US disclosed
US-12037324-B2 Biarylmethyl heterocycles BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-16 US disclosed
US-12037447-B2 Systems and processes for polymer production NOVOMER, INC. (US) 2024-07-16 US disclosed
CN-118159625-A Flame retardant composition, flame retardant resin composition, and molded article 株式会社ADEKA 2024-06-07 CN disclosed
CN-117946180-A Chiral iridium complex and preparation method and application thereof 南方科技大学 2024-04-30 CN disclosed
US-11912714-B2 Spiropyrrolidine derived antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2024-02-27 US disclosed
US-11912714-B2 Spiropyrrolidine derived antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2024-02-27 US disclosed
CN-117580906-A Nucleating agent composition, resin composition, molded article thereof, and method for producing resin composition 株式会社ADEKA 2024-02-20 CN disclosed
US-11858945-B2 Alkyne-containing antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2024-01-02 US disclosed
WO-2008010601-A1 NF- ϰB INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-01-24 WO disclosed
WO-2007119600-A1 CARBAZOLE COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-10-25 WO disclosed
US-20070179173-A1 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-02 US disclosed
US-20070111981-A1 New (hetero)aryl compounds with MCH antagonistic activity and medicaments comprising these compounds ROTH GERALD J 2007-05-17 US disclosed
US-20070054933-A1 17-Heterocyclic-4-azasteroid derivatives as androgen receptor modulators MERCK & CO., INC (US) 2007-03-08 US disclosed
US-7071282-B2 Benzimidazole diamine-based polyetherimide compositions and methods for making them GENERAL ELECTRIC COMPANY (US) 2006-07-04 US disclosed
EP-1633802-A1 BENZIMIDAZOLE DIAMINE-BASED POLYETHERIMIDE COMPOSITIONS AND METHODS FOR MAKING THEM GENERAL ELECTRIC COMPANY (US) 2006-03-15 EP disclosed
WO-2004108797-A1 BENZIMIDAZOLE DIAMINE-BASED POLYETHERIMIDE COMPOSITIONS AND METHODS FOR MAKING THEM GENERAL ELECTRIC COMPANY (US) 2004-12-16 WO disclosed
US-20040249117-A1 Benzimidazole diamine-based polyetherimide compositions and methods for making them GENERAL ELECTRIC COMPANY 2004-12-09 US disclosed
US-20040082578-A1 Arylindenopyridines and related therapeutic and prophylactic methods ORTHO-MCNEIL PHARMACEUTICAL, INC. 2004-04-29 US 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 (8 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-20070111981-A1 New (hetero)aryl compounds with MCH antagonistic activity and medicaments comprising these compounds MCHR1, GPR119, MCHR2 MEN1 2624/4885KMT2A 474/4885HTT 582/4885
US-20040082578-A1 Arylindenopyridines and related therapeutic and prophylactic methods ADORA2A, ADORA1, PDE2A MEN1 3926/4885KMT2A 2302/4885HTT 2566/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 MEN1 3912/4885KMT2A 2732/4885HTT 4175/4885
US-11912714-B2 Spiropyrrolidine derived antiviral agents ACE, ACE2, PKD1 MEN1 3064/4885KMT2A 4262/4885HTT 2222/4885
US-12037447-B2 Systems and processes for polymer production PGLS, APC, PHYKPL MEN1 535/4885KMT2A 4550/4885HTT 254/4885
US-11858945-B2 Alkyne-containing antiviral agents ACE, SARS1, ACE2 MEN1 4315/4885KMT2A 3482/4885HTT 2429/4885
US-20070054933-A1 17-Heterocyclic-4-azasteroid derivatives as androgen receptor modulators AR, SHBG, NR5A1 MEN1 2893/4885KMT2A 1470/4885HTT 1273/4885
US-12037324-B2 Biarylmethyl heterocycles ARRB1, ADRB2, ADRB1 MEN1 4154/4885KMT2A 3170/4885HTT 4236/4885

“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.