SCHEMBL723323

SCHEMBL723323

C1=CCC(CCc2cccc3c2Cc2ccccc2-3)=C1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.53
DRD2 P14416 2/20 0.42
DRD4 P21917 2/20 0.42
DRD3 P35462 2/20 0.42
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
HTR7 P34969 1/20 0.33
HTR2B P41595 1/20 0.33
PGR P06401 2/20 0.32
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
Hydrochloric Acid SCHEMBL9067828 0.97 PNMT (0.50) PNMTDRD2DRD4DRD3NPC1
Hydrochloric Acid SCHEMBL6557629 0.97 PNMT (0.50) PNMTDRD2DRD4DRD3NPC1
Hydrochloric Acid SCHEMBL6557725 0.89 PNMT (0.48) PNMTDRD2DRD4DRD3NPC1
SCHEMBL3994174 0.87 PNMT (0.54) PNMTDRD2DRD4DRD3NPC1
SCHEMBL7677548 0.86 PNMT (0.53) PNMTDRD2DRD4DRD3NPC1
Hydrochloric Acid SCHEMBL7190352 0.84 PNMT (0.51) PNMTDRD2DRD4DRD3NPC1
Hydrochloric Acid SCHEMBL5346821 0.84 PNMT (0.51) PNMTDRD2DRD4DRD3NPC1
Hydrochloric Acid SCHEMBL5347439 0.84 PNMT (0.51) PNMTDRD2DRD4DRD3NPC1
Hydrochloric Acid SCHEMBL5348858 0.84 PNMT (0.51) PNMTDRD2DRD4DRD3NPC1
Hydrochloric Acid SCHEMBL7642649 0.84 PNMT (0.51) PNMTDRD2DRD4DRD3NPC1

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-1068829-A Organometallic fluorenyl compounds and preparation thereof and application PHILLIPS PETROLEUM CO (US) 1993-02-10 CN claimed
EP-2226326-B1 METHOD FOR PRODUCING ORGANIC ALKALI METAL COMPOUND AND METHOD FOR PRODUCING ORGANIC TRANSITION METAL COMPOUND MITSUI CHEMICALS INC (JP) 2016-02-17 EP disclosed
US-8409480-B2 Process for preparing organic alkali metal compound and organic transition metal compound MITSUI CHEMICALS, INC. (JP) 2013-04-02 US disclosed
US-20120049391-A1 PROCESS FOR PREPARING ORGANIC ALKALI METAL COMPOUND AND ORGANIC TRANSITION METAL COMPOUND MITSUI CHEMICALS, INC. 2012-03-01 US disclosed
CN-101874033-A Method for producing organic alkali metal compound and method for producing organic transition metal compound MITSUI CHEMICALS INC 2010-10-27 CN disclosed
EP-2226326-A1 METHOD FOR PRODUCING ORGANIC ALKALI METAL COMPOUND AND METHOD FOR PRODUCING ORGANIC TRANSITION METAL COMPOUND Mitsui Chemicals, Inc. (JP) 2010-09-08 EP disclosed
US-6255417-B1 PREPARING OLEFINIC POLYMER IN ALIPHATIC HYDROCARBON SOLVENT USING MODIFIED METALLOCENE CATALYST HAVING AT LEAST ONE ALKYL SUBSTITUENT TO INCREASE SOLUBILITY IN SOLVENT, THEREBY INCREASING ACTIVITY LG CHEMICAL LTD. (KR) 2001-07-03 US disclosed
EP-0666267-B1 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 2001-04-18 EP disclosed
EP-0863920-B1 PROCESS FOR THE PREPARATION OF OLEFINIC POLYMERS USING METALLOCENE CATALYST LG CHEMICAL LTD (KR) 2001-02-07 EP disclosed
CN-1060176-C Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 2001-01-03 CN disclosed
EP-0863920-A1 PROCESS FOR THE PREPARATION OF OLEFINIC POLYMERS USING METALLOCENE CATALYST LG Chemical Limited (KR) 1998-09-16 EP disclosed
WO-1997019960-A1 PROCESS FOR THE PREPARATION OF OLEFINIC POLYMERS USING METALLOCENE CATALYST LG CHEMICAL LTD. (KR) 1997-06-05 WO disclosed
US-5571880-A CATALYSTS FOR POLYMERIZATION OF OLEFINS ESPECIALLY TO OBTAIN SYNDIOTACTIC POLYMERS PHILLIPS PETROLEUM COMPANY (US) 1996-11-05 US disclosed
CN-1109472-A Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 1995-10-04 CN disclosed
EP-0666267-A2 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1995-08-09 EP 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-20120049391-A1 PROCESS FOR PREPARING ORGANIC ALKALI METAL COMPOUND AND ORGANIC TRANSITION METAL COMPOUND NHP2, SSRP1, RER1 PNMT 2836/4885DRD2 2863/4885DRD4 2365/4885

“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.