4-Nitroaniline

4-Nitroaniline

SCHEMBL4208296

CC.Nc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.90

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.90
KMT2A Q03164 3/20 0.69
MEN1 O00255 2/20 0.69
MAPT P10636 1/20 0.69
ESR1 P03372 2/20 0.63
CYP19A1 P11511 2/20 0.63
ESR2 Q92731 2/20 0.63
HSD17B10 Q99714 2/20 0.58
ACHE P22303 1/20 0.58
PKM P14618 1/20 0.55
CYP3A4 P08684 3/20 0.54
TDP1 Q9NUW8 3/20 0.54
KDM4E B2RXH2 1/20 0.53
NPC1 O15118 1/20 0.53
GAA P10253 1/20 0.53
THRB P10828 1/20 0.53
ALOX12 P18054 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
LOXL2 Q9Y4K0 1/20 0.52

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
4-Nitroaniline SCHEMBL16451 0.95 ALDH1A1 (1.00) ALDH1A1KMT2AMEN1MAPTESR1
4-Nitroaniline SCHEMBL13529022 0.95 ALDH1A1 (1.00) ALDH1A1KMT2AMEN1MAPTESR1
SCHEMBL9065915 0.95 ALDH1A1 (1.00) ALDH1A1KMT2AMEN1MAPTESR1
4-Nitroaniline SCHEMBL27963818 0.95 ALDH1A1 (1.00) ALDH1A1KMT2AMEN1MAPTESR1
4-Nitroaniline SCHEMBL28869855 0.93 ALDH1A1 (0.86) ALDH1A1KMT2AMEN1MAPTESR1
4-Nitroaniline SCHEMBL11498181 0.92 ALDH1A1 (0.95) ALDH1A1KMT2AMEN1MAPTESR1
4-Nitroaniline SCHEMBL7158084 0.92 ALDH1A1 (0.95) ALDH1A1KMT2AMEN1MAPTESR1
4-Nitroaniline SCHEMBL356765 0.92 ALDH1A1 (0.95) ALDH1A1KMT2AMEN1MAPTESR1
4-Nitroaniline SCHEMBL21825602 0.92 ALDH1A1 (0.95) ALDH1A1KMT2AMEN1MAPTESR1
4-Nitroaniline SCHEMBL6956705 0.92 ALDH1A1 (0.95) ALDH1A1KMT2AMEN1MAPTESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9765053-B2 Methods of treatment using selective 5-HT2A inverse agonists ACADIA PHARMACEUTICALS INC. (US) 2017-09-19 US disclosed
US-20170165273-A9 METHODS OF TREATMENT USING SELECTIVE 5-HT2A INVERSE AGONISTS ANDERSSON CARL-MAGNUS A (DK) 2017-06-15 US disclosed
EP-1787984-B1 AZACYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF SEROTONIN RELATED DISEASES ACADIA PHARM INC (US) 2016-10-19 EP disclosed
US-20160237036-A1 AZACYCLIC COMPOUNDS ACADIA PHARM INC (US) 2016-08-18 US disclosed
US-9296694-B2 Azacyclic compounds ACADIA PHARMACEUTICALS INC. (US) 2016-03-29 US disclosed
US-20150259291-A1 AZACYCLIC COMPOUNDS ACADIA PHARMACEUTICALS INC. 2015-09-17 US disclosed
CN-1443167-B Azacyclo compounds for the treatment of 5-hydroxytryptamine related disorders ACADIA PHARM INC 2012-07-18 CN disclosed
US-20110301191-A1 METHODS OF TREATMENT USING SELECTIVE 5-HT2A INVERSE AGONISTS ANDERSSON CARL-MAGNUS A (DK) 2011-12-08 US disclosed
US-20090186921-A1 AZACYCLIC COMPOUNDS ACADIA PHARMACEUTICALS, INC. (US) 2009-07-23 US disclosed
CN-101230034-A Nitrogen hetero-cycle compounds for use in the treatment of 5-hydroxide tryptamines related diseases ACADIA PHARM INC (US) 2008-07-30 CN disclosed
US-20060194778-A1 Serotonin receptor antagonist; psychological disorders; side effect reduction ACADIA PHARMACEUTICALS, INC. 2006-08-31 US disclosed
US-20060194834-A1 Azacyclic compounds ACADIA PHARMACEUTICALS, INC. 2006-08-31 US disclosed
US-20050014757-A1 Azacyclic compounds ANDERSSON CARL-MAGNUS A (DK) 2005-01-20 US disclosed
US-6815458-B2 NERVOUS SYSTEM DISORDERS ACADIA PHARMACEUTICALS, INC 2004-11-09 US disclosed
US-6756393-B2 AMIDES AND UREAS N-SUBSTITUTED WITH PIPERIDINE OR NORTROPANE; SEROTONIN INVERSE AGONISTS OR ANTAGONISTS; ANTIPSYCHOTIC ACADIA PHARMACEUTICALS, INC. 2004-06-29 US disclosed
US-20030220316-A1 Azacyclic compounds ACADIA PHARMACEUTICALS INC. 2003-11-27 US disclosed
CN-1443167-A Azacyclo compounds for the treatment of 5-hydroxytryptamine related disorders ACADIA PHARM INC (US) 2003-09-17 CN disclosed
EP-1263729-A1 AZACYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF SEROTONIN RELATED DISEASES Acadia Pharmaceuticals Inc. (US) 2002-12-11 EP disclosed
US-20020004513-A1 Azacyclic compounds ACADIA PHARMACEUTICALS INC. 2002-01-10 US disclosed
WO-2001066521-A1 AZACYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF SEROTONIN RELATED DISEASES ACADIA PHARMACEUTICALS, INC. (US) 2001-09-13 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 (10 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-20150259291-A1 AZACYCLIC COMPOUNDS HTR6, TPMT, HNMT ALDH1A1 1093/4885KMT2A 958/4885MEN1 570/4885
US-20110301191-A1 METHODS OF TREATMENT USING SELECTIVE 5-HT2A INVERSE AGONISTS HTR2A, HTR5A, HTR3B ALDH1A1 2458/4885KMT2A 1969/4885MEN1 1617/4885
US-20060194834-A1 Azacyclic compounds HTR6, HTR5A, HNMT ALDH1A1 1235/4885KMT2A 1270/4885MEN1 710/4885
US-20090186921-A1 AZACYCLIC COMPOUNDS HTR6, HTR5A, HNMT ALDH1A1 1235/4885KMT2A 1270/4885MEN1 710/4885
US-20030220316-A1 Azacyclic compounds HTR6, TPMT, HNMT ALDH1A1 1093/4885KMT2A 958/4885MEN1 570/4885
US-20020004513-A1 Azacyclic compounds HTR6, TPMT, HNMT ALDH1A1 1093/4885KMT2A 958/4885MEN1 570/4885
US-20050014757-A1 Azacyclic compounds HTR6, TPMT, HNMT ALDH1A1 1093/4885KMT2A 958/4885MEN1 570/4885
US-20170165273-A9 METHODS OF TREATMENT USING SELECTIVE 5-HT2A INVERSE AGONISTS HTR2A, HTR5A, HTR3B ALDH1A1 2458/4885KMT2A 1969/4885MEN1 1617/4885
US-20160237036-A1 AZACYCLIC COMPOUNDS HTR6, TPMT, HNMT ALDH1A1 1093/4885KMT2A 958/4885MEN1 570/4885
US-20060194778-A1 Serotonin receptor antagonist; psychological disorders; side effect reduction HTR2A, HTR1A, HTR1B ALDH1A1 2975/4885KMT2A 1361/4885MEN1 2340/4885

“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.