SCHEMBL9330147

SCHEMBL9330147

OC(c1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 7/20 0.87
HTR2C P28335 3/20 0.87
HTR7 P34969 2/20 0.87
KDM4E B2RXH2 1/20 0.82
CYP1A2 P05177 1/20 0.82
CYP3A4 P08684 1/20 0.82
CYP2D6 P10635 1/20 0.82
TSHR P16473 1/20 0.82
HTR6 P50406 1/20 0.70

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
SCHEMBL9328582 0.95 HTR2A (0.87) HTR2AHTR2CHTR7KDM4ECYP1A2
SCHEMBL9375973 0.91 HTR2A (1.00) HTR2AHTR2CHTR7KDM4ECYP1A2
Glemanserin SCHEMBL120012 0.90 HTR2A (1.00) HTR2AHTR2CHTR7KDM4ECYP1A2
Glemanserin SCHEMBL7838106 0.89 HTR2A (0.97) HTR2AHTR2CHTR7KDM4ECYP1A2
SCHEMBL9328976 0.88 HTR2A (0.84) HTR2AHTR2CHTR7KDM4ECYP1A2
SCHEMBL9328969 0.87 HTR2A (0.82) HTR2AHTR2CHTR7KDM4ECYP1A2
SCHEMBL9179569 0.87 HTR2A (0.82) HTR2AHTR2CHTR7KDM4ECYP1A2
Hydrochloric Acid SCHEMBL9649750 0.86 HTR2A (0.80) HTR2AHTR2CHTR7KDM4ECYP1A2
SCHEMBL9329079 0.84 HTR2A (0.76) HTR2AHTR2CHTR7KDM4ECYP1A2
Hydrochloric Acid SCHEMBL9649783 0.83 HTR2A (0.74) HTR2AHTR2CHTR7KDM4ECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0325063-B1 Use of 1,4-disubstituted-piperidinyl compounds in the manufacture of a medicament for the treatment of insomnia MERRELL DOW PHARMA (US) 1994-03-09 EP claimed
US-4908369-A Use of 1,4-disubstituted-piperidinyl compounds in the manufacture of a medicament for the treatment of insomnia MERRELL DOW PHARMACEUTICALS INC. (US) 1990-03-13 US claimed
EP-0337136-A2 Piperidine derivatives in the treatment of extrapyramidal side effects associated with neuroleptic therapy MERRELL DOW PHARMACEUTICALS INC. (US) 1989-10-18 EP claimed
EP-0319962-A2 Piperidinyl methanol derivatives for the treatment of anxiety MERRELL DOW PHARMACEUTICALS INC. (US) 1989-06-14 EP claimed
US-20090075974-A1 AGENT FOR PROPHYLAXIS AND TREATMENT OF PANCREATITIS UMN PHARMA INC. (JP) 2009-03-19 US disclosed
US-20090075974-A1 AGENT FOR PROPHYLAXIS AND TREATMENT OF PANCREATITIS UMN PHARMA INC. (JP) 2009-03-19 US disclosed
EP-0325063-B1 Use of 1,4-disubstituted-piperidinyl compounds in the manufacture of a medicament for the treatment of insomnia MERRELL DOW PHARMA (US) 1994-03-09 EP disclosed
US-5169096-A Serotonin antagonists, analgesics MERRELL DOW PHARMACEUTICALS INC. (US) 1992-12-08 US disclosed
US-5106855-A Method for the treatment of glaucoma MERRELL DOW PHARMACEUTICALS INC. (US) 1992-04-21 US disclosed
EP-0434021-A2 4-Piperidine methanol derivatives for the treatment of glaucoma MERRELL PHARMACEUTICALS INC. (US) 1991-06-26 EP disclosed
US-5021428-A Novel chemical compounds for the prophylactic treatment of migraine MERRELL DOW PHARMACEUTICALS INC. (US) 1991-06-04 US disclosed
US-4912117-A Therapy for varient angina MERRELL DOW PHARMACEUTICALS INC. (US) 1990-03-27 US disclosed
US-4908369-A Use of 1,4-disubstituted-piperidinyl compounds in the manufacture of a medicament for the treatment of insomnia MERRELL DOW PHARMACEUTICALS INC. (US) 1990-03-13 US disclosed
EP-0208235-B1 N-ARALKYL PIPERIDINEMETHANOL DERIVATIVES MERRELL DOW PHARMACEUTICALS INC. (US) 1990-01-10 EP disclosed
EP-0337136-A2 Piperidine derivatives in the treatment of extrapyramidal side effects associated with neuroleptic therapy MERRELL DOW PHARMACEUTICALS INC. (US) 1989-10-18 EP disclosed
EP-0325063-A1 Use of 1,4-disubstituted-piperidinyl compounds in the manufacture of a medicament for the treatment of insomnia MERRELL DOW PHARMACEUTICALS INC. (US) 1989-07-26 EP disclosed
EP-0319962-A2 Piperidinyl methanol derivatives for the treatment of anxiety MERRELL DOW PHARMACEUTICALS INC. (US) 1989-06-14 EP disclosed
US-4783471-A N-aralkyl piperidine methanol derivatives and the uses thereof MERRELL DOW PHARMACEUTICALS INC. (US) 1988-11-08 US disclosed
EP-0208235-A1 N-Aralkyl piperidinemethanol derivatives MERRELL DOW PHARMACEUTICALS INC. (US) 1987-01-14 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-20090075974-A1 AGENT FOR PROPHYLAXIS AND TREATMENT OF PANCREATITIS HTR2A, HTR2B, HTR2C HTR2A 1/4885HTR2C 3/4885HTR7 18/4885

“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.