SCHEMBL9011796

SCHEMBL9011796

CCCCOCCCCCOCCCC

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.63
THRB P10828 2/20 0.62
HTT P42858 2/20 0.62
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
MAPT P10636 1/20 0.62
CYP3A4 P08684 1/20 0.52
CES2 O00748 2/20 0.50
ADRB2 P07550 1/20 0.47
ADRB1 P08588 1/20 0.47
ADRB3 P13945 1/20 0.47
ALDH1A1 P00352 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
USP2 O75604 1/20 0.46
CES1 P23141 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL6281191 1.00 TSHR (0.63) TSHRTHRBHTTMEN1KMT2A
SCHEMBL14658115 1.00 TSHR (0.63) TSHRTHRBHTTMEN1KMT2A
SCHEMBL9011548 1.00 TSHR (0.63) TSHRTHRBHTTMEN1KMT2A
SCHEMBL10950022 1.00 TSHR (0.63) TSHRTHRBHTTMEN1KMT2A
SCHEMBL9011718 1.00 TSHR (0.63) TSHRTHRBHTTMEN1KMT2A
SCHEMBL199075 0.97 THRB (0.67) TSHRTHRBHTTMEN1KMT2A
SCHEMBL199223 0.97 THRB (0.67) TSHRTHRBHTTMEN1KMT2A
SCHEMBL20842523 0.97 THRB (0.67) TSHRTHRBHTTMEN1KMT2A
SCHEMBL199279 0.97 THRB (0.67) TSHRTHRBHTTMEN1KMT2A
SCHEMBL127318 0.97 THRB (0.67) TSHRTHRBHTTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111440132-B Novel method for preparing oxygen heterocyclic compound by ionic liquid catalysis 中国科学院化学研究所 2022-02-01 CN claimed
CN-111440132-A Novel method for preparing oxygen heterocyclic compound by ionic liquid catalysis 中国科学院化学研究所 2020-07-24 CN claimed
US-20230398226-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS CIDARA THERAPEUTICS, INC. 2023-12-14 US disclosed
US-11833213-B2 Compositions and methods for the treatment of viral infections CIDARA THERAPEUTICS, INC. (US) 2023-12-05 US disclosed
CN-111440132-B Novel method for preparing oxygen heterocyclic compound by ionic liquid catalysis 中国科学院化学研究所 2022-02-01 CN disclosed
EP-2735581-B1 COMPOSITION AND POLYMER ASAHI CHEMICAL IND (JP) 2021-07-14 EP disclosed
CN-111440132-A Novel method for preparing oxygen heterocyclic compound by ionic liquid catalysis 中国科学院化学研究所 2020-07-24 CN disclosed
US-9738757-B2 Composition and polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2017-08-22 US disclosed
US-20160222168-A1 Composition and Polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2016-08-04 US disclosed
US-9334371-B2 Composition and polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2016-05-10 US disclosed
US-9309481-B2 Lubricant composition IDEMITSU KOSAN CO., LTD. (JP) 2016-04-12 US disclosed
EP-2735581-A1 COMPOSITION AND POLYMER Asahi Kasei Chemicals Corporation (JP) 2014-05-28 EP disclosed
US-20140121293-A1 Composition and Polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2014-05-01 US disclosed
US-20130005624-A1 LUBRICANT COMPOSITION IDEMITSU KOSAN CO., LTD. (JP) 2013-01-03 US disclosed
US-5529874-A ETHER CARRIER LIQUID AND TONER PARTICLES DISPERSED THEREIN; SUITABLE FOR HIGH SPEED COPYING FUJI XEROX CO., LTD. (JP) 1996-06-25 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 (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-20230398226-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS FCGR3B, ALB, FCGR1A TSHR 2184/4885THRB 2870/4885HTT 4145/4885
US-11833213-B2 Compositions and methods for the treatment of viral infections FCGR3B, ALB, FCGR1A TSHR 2184/4885THRB 2870/4885HTT 4145/4885

“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.