SCHEMBL6266901

SCHEMBL6266901

CCN(CC)Cc1cc(C)ccc1O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.67
ALDH1A1 P00352 4/20 0.67
MAPT P10636 4/20 0.67
HTT P42858 2/20 0.67
TDP1 Q9NUW8 2/20 0.67
MEN1 O00255 2/20 0.67
KMT2A Q03164 2/20 0.67
KDM4E B2RXH2 1/20 0.67
THRB P10828 1/20 0.67
APEX1 P27695 1/20 0.67
MAPK1 P28482 1/20 0.67
RECQL P46063 1/20 0.67
CACNA1B Q00975 1/20 0.67
APBA1 Q02410 1/20 0.67
MCL1 Q07820 1/20 0.67
HKDC1 Q2TB90 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
PRKCI P41743 1/20 0.67
ACHE P22303 1/20 0.65
JAK2 O60674 1/20 0.61

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
SCHEMBL15383500 0.91 PRKCI (0.56) POLBALDH1A1MAPTHTTTDP1
SCHEMBL15383502 0.89 AMY1A (0.61) POLBALDH1A1MAPTHTTTDP1
SCHEMBL20175929 0.88 PRKCI (0.53) POLBALDH1A1MAPTHTTTDP1
SCHEMBL23080065 0.83 TAAR1 (0.50) POLBALDH1A1MAPTHTTTDP1
SCHEMBL11131965 0.82 POLB (0.69) POLBALDH1A1MAPTHTTTDP1
SCHEMBL13799707 0.81 PRKCI (0.62) POLBALDH1A1MAPTHTTTDP1
SCHEMBL15999194 0.80 JAK2 (0.85) POLBALDH1A1MAPTHTTTDP1
Bromide SCHEMBL11132004 0.80 POLB (0.67) POLBALDH1A1MAPTHTTTDP1
SCHEMBL11269728 0.80 POLB (0.67) POLBALDH1A1MAPTHTTTDP1
SCHEMBL11622498 0.80 PRKCI (0.52) POLBALDH1A1MAPTHTTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005087901-A2 FUEL ADDITIVE COMPOSITION HAVING ANTIKNOCK PROPERTIES INNOSPEC LIMITED (GB) 2005-09-22 WO claimed
US-9868975-B2 Use of known compounds as D-amino acid oxidase inhibitors Tseng, Yufeng Jane (US) 2018-01-16 US disclosed
US-20170037448-A1 USE OF KNOWN COMPOUNDS AS D-AMINO ACID OXIDASE INHIBITORS TSENG, YUFENG JANE 2017-02-09 US disclosed
US-7655688-B2 Treating nuclear hormone receptor-associated conditions such as cancer and immune disorders; (3a alpha ,4 alpha ,7 alpha ,7a alpha )-2-(3-Chloro-4-hydroxyphenyl)hexahydro-4,7-methano-1H-isoindole-1,3(2H)-dione BRISTOL-MYERS SQUIBB COMPANY (US) 2010-02-02 US disclosed
US-7655688-B2 Treating nuclear hormone receptor-associated conditions such as cancer and immune disorders; (3a alpha ,4 alpha ,7 alpha ,7a alpha )-2-(3-Chloro-4-hydroxyphenyl)hexahydro-4,7-methano-1H-isoindole-1,3(2H)-dione BRISTOL-MYERS SQUIBB COMPANY (US) 2010-02-02 US disclosed
US-20080227785-A1 2,4,6-TRIAMINO-1,3,5-TRIAZINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2008-09-18 US disclosed
US-20080227785-A1 2,4,6-TRIAMINO-1,3,5-TRIAZINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2008-09-18 US disclosed
US-7375222-B2 2,4,6-Triamino-1,3,5-triazine derivative ASTELLAS PHARMA INC. (JP) 2008-05-20 US disclosed
US-7375222-B2 2,4,6-Triamino-1,3,5-triazine derivative ASTELLAS PHARMA INC. (JP) 2008-05-20 US disclosed
WO-2005087901-A2 FUEL ADDITIVE COMPOSITION HAVING ANTIKNOCK PROPERTIES INNOSPEC LIMITED (GB) 2005-09-22 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 (2 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-20080227785-A1 2,4,6-TRIAMINO-1,3,5-TRIAZINE DERIVATIVE KCNT1, KCNMA1, KCNJ2 POLB 3986/4885ALDH1A1 2383/4885MAPT 158/4885
US-20170037448-A1 USE OF KNOWN COMPOUNDS AS D-AMINO ACID OXIDASE INHIBITORS DAO, DDO, DDC POLB 1285/4885ALDH1A1 182/4885MAPT 3546/4885

“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.