SCHEMBL1155059

SCHEMBL1155059

CC(O)c1cccc(I)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
UGT2B7 P16662 1/20 0.47
SLC6A3 Q01959 3/20 0.42
CYP3A4 P08684 2/20 0.42
CYP2D6 P10635 2/20 0.42
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
KCNH2 Q12809 2/20 0.42
BRD4 O60885 1/20 0.41
BRD2 P25440 1/20 0.41
CREBBP Q92793 1/20 0.41
KDM4E B2RXH2 2/20 0.39
ADRB1 P08588 1/20 0.38
MIF P14174 1/20 0.38
HTR2A P28223 1/20 0.38
ADRA1A P35348 1/20 0.38
HTR2B P41595 1/20 0.38
LMNA P02545 3/20 0.38
PTPN5 P54829 1/20 0.38

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
SCHEMBL9331659 0.83 UGT2B7 (0.56) MEN1KMT2AUGT2B7CYP3A4BRD4
SCHEMBL9331663 0.83 UGT2B7 (0.56) MEN1KMT2AUGT2B7CYP3A4BRD4
SCHEMBL9334664 0.83 UGT2B7 (0.56) MEN1KMT2AUGT2B7CYP3A4BRD4
SCHEMBL2812852 0.83 UGT2B7 (0.56) MEN1KMT2AUGT2B7CYP3A4BRD4
SCHEMBL15051228 0.83 CYP3A4 (0.47) MEN1KMT2ASLC6A3CYP3A4CYP2D6
SCHEMBL15050444 0.83 CYP3A4 (0.47) MEN1KMT2ASLC6A3CYP3A4CYP2D6
SCHEMBL15050445 0.83 CYP3A4 (0.47) MEN1KMT2ASLC6A3CYP3A4CYP2D6
SCHEMBL15051229 0.83 CYP3A4 (0.47) MEN1KMT2ASLC6A3CYP3A4CYP2D6
SCHEMBL15050442 0.83 CYP3A4 (0.47) MEN1KMT2ASLC6A3CYP3A4CYP2D6
SCHEMBL6345064 0.81 CYP3A4 (0.47) SLC6A3CYP3A4CYP2D6SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240208945-A1 6-CARBAMATE SUBSTITUTED HETEROARYL RING DERIVATIVES MEDSHINE DISCOVERY INC. (CN) 2024-06-27 US disclosed
US-20240174683-A1 MAP4K1 INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2024-05-30 US disclosed
WO-2022199670-A1 6-CARBAMATE SUBSTITUTED HETEROARYL RING DERIVATIVES 南京明德新药研发有限公司 2022-09-29 WO disclosed
US-11031561-B2 Organic electron transport material and organic electroluminescent element using same DYDEN CORPORATION (JP) 2021-06-08 US disclosed
US-20200168807-A1 ORGANIC ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME DYDEN CORPORATION (JP) 2020-05-28 US disclosed
EP-3121176-A1 2,4-DIAMINOQUINAZOLINES FOR THE TREATMENT OF SPINAL MUSCULAR ATROPHY Families of Spinal Muscular Atrophy (US) 2017-01-25 EP disclosed
EP-1765810-B1 2,4-DIAMINOQUINAZOLINES FOR THE TREATMENT OF SPINAL MUSCULAR ATROPHY FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2016-08-17 EP disclosed
EP-2514748-B1 2,4-diaminoquinazolines for spinal muscular atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2016-08-10 EP disclosed
US-20160152577-A1 2,4-Diaminoquinazolines for Spinal Muscular Atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2016-06-02 US disclosed
US-9067897-B2 2,4-Diaminoquinazolines for spinal muscular atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2015-06-30 US disclosed
EP-2514748-A1 2,4-diaminoquinazolines for spinal muscular atrophy Families of Spinal Muscular Atrophy (US) 2012-10-24 EP disclosed
US-20110112118-A1 2,4-Diaminoquinazolines for Spinal Muscular Atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2011-05-12 US disclosed
US-7888366-B2 2,4-diaminoquinazolines for spinal muscular atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2011-02-15 US disclosed
WO-2009116577-A1 PROCESSES FOR PRODUCTION OF 1-(SUBSTITUTED PHENYL)-1- SUBSTITUTED SILYL ETHERS, ALCOHOLS OR KETONES, AND INTERMEDIATES 日産化学工業株式会社 (JP) 2009-09-24 WO disclosed
EP-1765810-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY Decode Chemistry, Inc. (US) 2007-03-28 EP disclosed
WO-2005123724-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY DECODE CHEMISTRY, INC. (US) 2005-12-29 WO disclosed
US-20050288314-A1 2,4-diaminoquinazolines for spinal muscular atrophy DECODE CHEMISTRY, INC. (US) 2005-12-29 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 (5 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-20110112118-A1 2,4-Diaminoquinazolines for Spinal Muscular Atrophy SMN1; SMN2, MUSK, MYO3B MEN1 2282/4885KMT2A 91/4885UGT2B7 2986/4885
US-20160152577-A1 2,4-Diaminoquinazolines for Spinal Muscular Atrophy SMN1; SMN2, MUSK, MYO3B MEN1 2282/4885KMT2A 91/4885UGT2B7 2986/4885
US-20050288314-A1 2,4-diaminoquinazolines for spinal muscular atrophy SMN1; SMN2, MUSK, MYO3B MEN1 2282/4885KMT2A 91/4885UGT2B7 2986/4885
US-20240174683-A1 MAP4K1 INHIBITORS MAP3K4, MAP4K4, MAP4K1 MEN1 468/4885KMT2A 2250/4885UGT2B7 4575/4885
US-20240208945-A1 6-CARBAMATE SUBSTITUTED HETEROARYL RING DERIVATIVES CYP3A7, UGT2B7, CYP51A1 MEN1 1598/4885KMT2A 1067/4885UGT2B7 2/4885

“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.