SCHEMBL29645065

SCHEMBL29645065

[Ti]C1C=Cc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.41
HTR6 P50406 1/20 0.40
SIGMAR1 Q99720 6/20 0.33
KDM4E B2RXH2 3/20 0.33
CYP2D6 P10635 2/20 0.33
TP53 P04637 2/20 0.33
CYP3A4 P08684 2/20 0.33
HSD17B10 Q99714 2/20 0.33
BRD4 O60885 1/20 0.33
CCL2 P13500 1/20 0.33
LMNA P02545 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
DRD2 P14416 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
NFKB1 P19838 1/20 0.33
CHRM3 P20309 1/20 0.33
SLC6A2 P23975 1/20 0.33
HTR2C P28335 1/20 0.33

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
SCHEMBL5888461 1.00 HTR2A (0.41) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Hydrochloric Acid SCHEMBL4855724 0.98 HTR2A (0.40) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Hydrochloric Acid SCHEMBL1929585 0.98 HTR2A (0.40) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Fluoride SCHEMBL7560410 0.98 HTR2A (0.40) HTR2AHTR6SIGMAR1KDM4ECYP2D6
SCHEMBL29633478 0.98 HTR2A (0.40) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Bromide SCHEMBL7531587 0.98 HTR2A (0.40) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Methyl Alcohol SCHEMBL5277893 0.93 HTR2A (0.38) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Dimethylamine SCHEMBL4622746 0.91 KDM4E (0.41) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Alcohol SCHEMBL8155328 0.88 HTR2A (0.38) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Phenol SCHEMBL5277434 0.88 CA12 (0.42) HTR2AHTR6SIGMAR1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12503525-B2 Biphenol metal complex, preparation method therefor and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2025-12-23 US disclosed
US-12448468-B2 Catalyst for olefin polymerization and polymerization method using same CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2025-10-21 US disclosed
CN-114599685-B Bisphenol metal complex and preparation method and application thereof 中国石油化工股份有限公司 2023-11-24 CN disclosed
CN-111902439-B Binuclear olefin polymerization activator 陶氏环球技术有限责任公司 2023-06-23 CN disclosed
US-20220380397-A1 BIPHENOL METAL COMPLEX, PREPARATION METHOD THEREFOR AND USE THEREOF BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY, CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2022-12-01 US disclosed
US-20220372177-A1 CATALYST FOR OLEFIN POLYMERIZATION AND POLYMERIZATION METHOD USING SAME CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2022-11-24 US disclosed
CN-110036041-B Transition metal compound for olefin polymerization catalyst, olefin polymerization catalyst comprising same, and polyolefin polymerized using same 韩华化学株式会社 2022-10-14 CN disclosed
US-20220324895-A1 DEPOLYMERIZATION AND VALORIZATION OF A BIOPOLYMER UNIV NEW YORK (US) 2022-10-13 US disclosed
EP-4053168-A1 CATALYST FOR OLEFIN POLYMERIZATION AND POLYMERIZATION METHOD USING SAME CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2022-09-07 EP disclosed
EP-4053167-A1 BIPHENOL METAL COMPLEX, PREPARATION METHOD THEREFOR AND USE THEREOF CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2022-09-07 EP disclosed
CN-114945602-A Catalyst for olefin polymerization and polymerization method using same 中国石油化工股份有限公司 2022-08-26 CN disclosed
CN-114599685-A Bisphenol metal complex and preparation method and application thereof 中国石油化工股份有限公司 2022-06-07 CN 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 (5 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-12503525-B2 Biphenol metal complex, preparation method therefor and use thereof ASH2L, WEE2, WEE1 HTR2A 4280/4885HTR6 3987/4885SIGMAR1 1207/4885
US-20220380397-A1 BIPHENOL METAL COMPLEX, PREPARATION METHOD THEREFOR AND USE THEREOF ASH2L, CYP27B1, MSMO1 HTR2A 3931/4885HTR6 3658/4885SIGMAR1 1188/4885
US-20220372177-A1 CATALYST FOR OLEFIN POLYMERIZATION AND POLYMERIZATION METHOD USING SAME CBR3, CBR1, AOC2 HTR2A 4186/4885HTR6 2130/4885SIGMAR1 247/4885
US-12448468-B2 Catalyst for olefin polymerization and polymerization method using same CBR3, CBR1, AOC2 HTR2A 4186/4885HTR6 2130/4885SIGMAR1 247/4885
US-20220324895-A1 DEPOLYMERIZATION AND VALORIZATION OF A BIOPOLYMER ALG1, PPOX, MANBA HTR2A 4669/4885HTR6 4781/4885SIGMAR1 4213/4885

“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.