SCHEMBL4855690

SCHEMBL4855690

Oc1c[nH]c2ccccc12.[NaH]

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
CYP3A4 P08684 3/20 0.56
GPR84 Q9NQS5 2/20 0.56
MAPT P10636 2/20 0.56
AHR P35869 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
ATM Q13315 2/20 0.52
ALDH1A1 P00352 3/20 0.48
CYP2D6 P10635 2/20 0.48
CYP2A6 P11509 2/20 0.48
MPO P05164 1/20 0.48
CYP1A2 P05177 1/20 0.48
NFKB1 P19838 1/20 0.48
HTR1D P28221 1/20 0.48
HTR1B P28222 1/20 0.48
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
HTR7 P34969 1/20 0.48
CTSK P43235 1/20 0.48

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
SCHEMBL27714884 0.98 MEN1 (0.54) MEN1KMT2ACYP3A4GPR84MAPT
SCHEMBL155191 0.98 MEN1 (0.58) MEN1KMT2ACYP3A4GPR84MAPT
SCHEMBL29567690 0.98 MEN1 (0.58) MEN1KMT2ACYP3A4GPR84MAPT
SCHEMBL28624457 0.95 MEN1 (0.56) MEN1KMT2ACYP3A4GPR84MAPT
SCHEMBL10550137 0.95 MEN1 (0.56) MEN1KMT2ACYP3A4GPR84MAPT
Water SCHEMBL27616945 0.95 MEN1 (0.56) MEN1KMT2ACYP3A4GPR84MAPT
Methane SCHEMBL5065725 0.95 MEN1 (0.56) MEN1KMT2ACYP3A4GPR84MAPT
SCHEMBL27702719 0.95 MEN1 (0.56) MEN1KMT2ACYP3A4GPR84MAPT
Hydrochloric Acid SCHEMBL28628671 0.95 MEN1 (0.56) MEN1KMT2ACYP3A4GPR84MAPT
Potassium Ion SCHEMBL8890535 0.93 MEN1 (0.54) MEN1KMT2ACYP3A4GPR84MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1204202-C Usage of indophenol salt in direct dyeing in situ HUIJU YINGLI MEDICAL CHEMISTRY (CN) 2005-06-01 CN claimed
CN-1204205-C Dyeing compon. for textile materials HUIJU YINGLI MEDICAL CHEMISTRY (CN) 2005-06-01 CN claimed
CN-1498923-A Dyeing compon. for textile materials 北京慧聚英力医药化学技术发展有限公 2004-05-26 CN claimed
CN-1498921-A Usage of indophenol salt in direct dyeing in situ 北京慧聚英力医药化学技术发展有限公 2004-05-26 CN claimed
CN-113473860-A 1, 3, 4-oxadiazoles and derivatives thereof as novel antifungal agents 拜耳公司 2021-10-01 CN disclosed
CN-213679851-U Indigo production ammonia recovery system 内蒙古兄弟化工有限公司 2021-07-13 CN disclosed
US-7323488-B2 Chromogenic enzyme substrates BURTON MICHAEL 2008-01-29 US disclosed
EP-1436411-B1 CHROMOGENIC ENZYME SUBSTRATES AND METHOD FOR DETECTING BETA-D-RIBOFURANOSIDASE ACTIVITY BURTON MICHAEL (GB) 2005-12-14 EP disclosed
US-20050124556-A1 Chromogenic enzyme substrates BURTON MICHAEL (GB) 2005-06-09 US disclosed
CN-1204202-C Usage of indophenol salt in direct dyeing in situ HUIJU YINGLI MEDICAL CHEMISTRY (CN) 2005-06-01 CN disclosed
CN-1204205-C Dyeing compon. for textile materials HUIJU YINGLI MEDICAL CHEMISTRY (CN) 2005-06-01 CN disclosed
EP-1436411-A2 CHROMOGENIC ENZYME SUBSTRATES AND METHOD FOR DETECTING BETA-D-RIBOFURANOSIDASE ACTIVITY Burton, Michael (GB) 2004-07-14 EP disclosed
CN-1498923-A Dyeing compon. for textile materials 北京慧聚英力医药化学技术发展有限公 2004-05-26 CN disclosed
CN-1498921-A Usage of indophenol salt in direct dyeing in situ 北京慧聚英力医药化学技术发展有限公 2004-05-26 CN disclosed
WO-2003035896-A2 CHROMOGENIC ENZYME SUBSTRATES AND METHOD FOR DETECTING BETA-D-RIBOFURANOSIDASE ACTIVITY BURTON MICHAEL (GB) 2003-05-01 WO disclosed
US-5122160-A Denim; vat dyes; redox system MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1992-06-16 US disclosed
CN-1052345-A Dyes, uses their cotton cord shape colouring method and dye thereof at rope-like dyeing dye composition MITSUI TOATSU CHEMICALS (JP) 1991-06-19 CN disclosed
EP-0431906-A2 Cotton rope-dyeing methods MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-06-12 EP 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 (1 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-20050124556-A1 Chromogenic enzyme substrates DCXR, MGAM, IDE MEN1 4538/4885KMT2A 4039/4885CYP3A4 228/4885

“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.