SCHEMBL1183199

SCHEMBL1183199

CCCc1cc(C)c(N)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
TP53 P04637 1/20 0.48
CYP3A4 P08684 1/20 0.48
TSHR P16473 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
SKP2 Q13309 1/20 0.45
POLB P06746 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
KDM4E B2RXH2 2/20 0.40
NOS2 P35228 2/20 0.38
NOS3 P29474 1/20 0.38
NOS1 P29475 1/20 0.38
HTT P42858 2/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35

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
SCHEMBL2153739 0.87 ALDH1A1 (0.55) ALDH1A1TP53CYP3A4TSHRTDP1
SCHEMBL11701754 0.86 SKP2 (0.62) ALDH1A1TP53CYP3A4TSHRTDP1
SCHEMBL11559770 0.85 ALDH1A1 (0.46) ALDH1A1TP53CYP3A4TSHRTDP1
SCHEMBL29611441 0.85 SKP2 (0.39) ALDH1A1TP53CYP3A4TSHRTDP1
SCHEMBL16337442 0.82 PTGS2 (0.53) ALDH1A1TP53CYP3A4SKP2KDM4E
SCHEMBL19480452 0.82 PTGS2 (0.53) ALDH1A1TP53CYP3A4SKP2KDM4E
SCHEMBL18830614 0.82 PTGS2 (0.53) ALDH1A1TP53CYP3A4SKP2KDM4E
SCHEMBL13984313 0.80 TAAR1 (0.50) ALDH1A1TP53CYP3A4TSHRTDP1
SCHEMBL5610598 0.79 ALDH1A1 (0.52) ALDH1A1TP53CYP3A4TSHRTDP1
SCHEMBL28131083 0.79 FFAR4 (0.47) ALDH1A1CYP3A4SKP2FFAR4HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117624221-A Aza-binuclear large-volume anionic-cationic complex, and preparation method and application thereof 中化学科学技术研究有限公司 2024-03-01 CN disclosed
CN-111133032-B Polyimide, polyimide varnish, and polyimide film 三菱瓦斯化学株式会社 2022-07-19 CN disclosed
CN-111051384-B Polyimide, polyimide varnish, and polyimide film 三菱瓦斯化学株式会社 2022-06-28 CN disclosed
CN-108884245-B Polyimide film and method for producing same 柯尼卡美能达株式会社 2021-10-29 CN disclosed
CN-109563280-B Polyimide resin film and method for producing polyimide resin film 三菱瓦斯化学株式会社 2021-10-15 CN disclosed
CN-109843534-B Method for manufacturing optical film 柯尼卡美能达株式会社 2021-05-18 CN disclosed
CN-109843533-B Method for manufacturing optical film 柯尼卡美能达株式会社 2021-05-04 CN disclosed
WO-2020195819-A1 METHOD FOR MANUFACTURING OPTICAL FILM AND OPTICAL FILM コニカミノルタ株式会社 2020-10-01 WO disclosed
CN-111183194-A Polyimide varnish composition, method for producing same, and polyimide film 三菱瓦斯化学株式会社 2020-05-19 CN disclosed
CN-111133032-A Polyimide, polyimide varnish, and polyimide film 三菱瓦斯化学株式会社 2020-05-08 CN disclosed
US-20030114472-A1 Viricides JANSSEN PHARMACEUTICA, N.V. (BE) 2003-06-19 US disclosed
EP-1002795-B1 HIV Replication inhibiting pyrimidines JANSSEN PHARMACEUTICA NV (BE) 2003-03-05 EP disclosed
EP-1282607-A2 PRODRUGS OF HIV REPLICATION INHIBITING PYRIMIDINES JANSSEN PHARMACEUTICA N.V. (BE) 2003-02-12 EP disclosed
EP-1270560-A1 Hiv replication inhibiting pyrimidines JANSSEN PHARMACEUTICA N.V. (BE) 2003-01-02 EP disclosed
EP-1225874-A1 ANTIVIRAL COMPOSITIONS Janssen Pharmaceutica N.V. (BE) 2002-07-31 EP disclosed
WO-2001085699-A2 PRODRUGS OF HIV REPLICATION INHIBITING PYRIMIDINES JANSSEN PHARMACEUTICA N.V. (BE) 2001-11-15 WO disclosed
WO-2001022938-A1 ANTIVIRAL COMPOSITIONS JANSSEN PHARMACEUTICA N.V. (BE) 2001-04-05 WO disclosed
EP-1002795-A1 HIV Replication inhibiting pyrimidines JANSSEN PHARMACEUTICA N.V. (BE) 2000-05-24 EP disclosed
WO-2000027825-A1 HIV REPLICATION INHIBITING PYRIMIDINES JANSSEN PHARMACEUTICA N.V. (BE) 2000-05-18 WO disclosed
US-4147804-A ANTIARRHYTHMIA AGENTS WILLIAM H. RORER, INC. (US) 1979-04-03 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-20030114472-A1 Viricides ZC3HAV1, ZC3HAV1L, POLR2H ALDH1A1 2470/4885TP53 1542/4885CYP3A4 1164/4885

“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.