SCHEMBL8972279

SCHEMBL8972279

CCCCNc1ccc(-c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
MAPT P10636 2/20 0.56
HDAC3 O15379 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
NCOR2 Q9Y618 1/20 0.50
ACP1 P24666 1/20 0.47
TLR8 Q9NR97 1/20 0.46
KCNH3 Q9ULD8 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
NPC1 O15118 1/20 0.44
STAT1 P42224 1/20 0.44
RAB9A P51151 1/20 0.44
ABCB1 P08183 1/20 0.44
ABCG2 Q9UNQ0 1/20 0.44
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL7089257 0.92 ALDH1A1 (0.52) ALDH1A1MAPTKCNH3NPC1STAT1
SCHEMBL27669287 0.92 ALDH1A1 (0.52) ALDH1A1MAPTKCNH3NPC1STAT1
SCHEMBL30800856 0.92 MAPT (0.46) ALDH1A1MAPTKCNH3RAB9ALMNA
SCHEMBL8260133 0.88 ALDH1A1 (0.48) ALDH1A1MAPTHDAC3HDAC1HDAC2
SCHEMBL49577 0.87 ALDH1A1 (0.73) ALDH1A1MAPTACP1KCNH3BCHE
Ammonia Solution, Strong SCHEMBL9312190 0.85 ALDH1A1 (0.70) ALDH1A1MAPTACP1KCNH3BCHE
Pentane SCHEMBL8628163 0.85 ALDH1A1 (0.70) ALDH1A1MAPTACP1KCNH3BCHE
SCHEMBL16101578 0.85 HRH3 (0.53) ALDH1A1MAPTKCNH3LMNABCHE
Hydrochloric Acid SCHEMBL5180822 0.85 ALDH1A1 (0.70) ALDH1A1MAPTACP1KCNH3RAB9A
Water SCHEMBL28107559 0.85 ALDH1A1 (0.70) ALDH1A1MAPTACP1KCNH3BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0596802-B1 Erythromycin derivatives, their process of preparation and their application as medicaments ROUSSEL UCLAF (FR) 1996-03-20 EP claimed
EP-0596802-A1 Erythromycin derivatives, their process of preparation and their application as medicaments ROUSSEL UCLAF (FR) 1994-05-11 EP claimed
EP-3240057-B1 ORGANIC ELECTROLUMINESCENT ELEMENT HODOGAYA CHEMICAL CO LTD (JP) 2021-04-07 EP disclosed
US-9346795-B2 Substituted sulfonamides useful as antiapoptotic Bcl inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2016-05-24 US disclosed
US-9346795-B2 Substituted sulfonamides useful as antiapoptotic Bcl inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2016-05-24 US disclosed
EP-2714681-B1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2015-06-24 EP disclosed
EP-2714681-B1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2015-06-24 EP disclosed
US-20140135318-A1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-05-15 US disclosed
US-20140135318-A1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-05-15 US disclosed
WO-2012162365-A1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2012-11-29 WO disclosed
CN-100374494-C Highly filled polymer compositions DOW GLOBAL TECHNOLOGIES INC (US) 2008-03-12 CN disclosed
CN-1705712-A Highly filled polymer compositions DOW GLOBAL TECHNOLOGIES INC (US) 2005-12-07 CN disclosed
EP-0596802-B1 Erythromycin derivatives, their process of preparation and their application as medicaments ROUSSEL UCLAF (FR) 1996-03-20 EP disclosed
EP-0596802-A1 Erythromycin derivatives, their process of preparation and their application as medicaments ROUSSEL UCLAF (FR) 1994-05-11 EP disclosed
US-4055664-A ANTIINFLAMMATORY, ANTIPYRETIC, ANALGESIC ARMOUR PHARMACEUTICAL COMPANY (US) 1977-10-25 US disclosed
US-4055664-A ANTIINFLAMMATORY, ANTIPYRETIC, ANALGESIC ARMOUR PHARMACEUTICAL COMPANY (US) 1977-10-25 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 (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-20140135318-A1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BCL2, BAX, BCL2A1 ALDH1A1 2963/4885MAPT 4608/4885HDAC3 534/4885

“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.