SCHEMBL902177

SCHEMBL902177

CCCCCC1CCNC1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 10/20 0.46
GNAI3 P08754 9/20 0.46
GNAI1 P63096 9/20 0.46
CYP1A2 P05177 2/20 0.41
SLC6A1 P30531 2/20 0.41
GABRA5 P31644 2/20 0.41
GABRB2 P47870 2/20 0.41
SLC6A12 P48065 2/20 0.41
SLC6A11 P48066 2/20 0.41
SLC6A13 Q9NSD5 2/20 0.41
GABRA1 P14867 1/20 0.41
GABRR1 P24046 1/20 0.41
GABRA4 P48169 1/20 0.41
KCNH2 Q12809 1/20 0.38
EPHX1 P07099 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL11161610 0.98 GNAO1 (0.49) GNAO1GNAI3GNAI1CYP1A2SLC6A1
SCHEMBL29336210 0.98 GNAO1 (0.49) GNAO1GNAI3GNAI1CYP1A2SLC6A1
SCHEMBL9408900 0.98 GNAO1 (0.49) GNAO1GNAI3GNAI1CYP1A2SLC6A1
SCHEMBL20858731 0.98 GNAO1 (0.49) GNAO1GNAI3GNAI1CYP1A2SLC6A1
Bromide SCHEMBL20550048 0.98 GNAO1 (0.45) GNAO1GNAI3GNAI1CYP1A2SLC6A1
SCHEMBL23717791 0.98 GNAO1 (0.49) GNAO1GNAI3GNAI1CYP1A2SLC6A1
SCHEMBL893557 0.93
SCHEMBL902268 0.88 CYP1A2 (0.48) GNAO1GNAI3GNAI1CYP1A2EPHX1
SCHEMBL14368874 0.88 CYP1A2 (0.48) GNAO1GNAI3GNAI1CYP1A2EPHX1
SCHEMBL14368866 0.88 CYP1A2 (0.48) GNAO1GNAI3GNAI1CYP1A2EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101036198-B Process for coating fine particles with conductive polymers CHEMETALL GMBH 2013-04-17 CN claimed
CN-101036198-A Process for coating fine particles with conductive polymers CHEMETALL GMBH (DE) 2007-09-12 CN claimed
US-20070039644-A1 Dye for dye sensitized photovoltaic cell and dye sensitized photovoltaic cell prepared using the same SAMSUNG SDI CO., LTD. (KR) 2007-02-22 US claimed
EP-1755178-A2 Dye for use in Dye Sensitized Photovoltaic Cell Samsung SDI Co., Ltd. (KR) 2007-02-21 EP claimed
EP-0309913-B1 Fungicidal N-substituted 3-aryl-pyrrolidine derivatives BASF AG (DE) 1994-06-15 EP claimed
US-5068245-A For treatment of plants BASF AKTIENGESELLSCHAFT (DE) 1991-11-26 US claimed
EP-4392411-A1 PROCESS FOR THE PREPARATION OF CHLOROALKYL SUBSTITUTED CYCLIC AMINES Hovione Farmaciencia SA (PT) 2024-07-03 EP disclosed
CN-118159526-A Process for preparing chloroalkyl substituted cyclic amines 好利安药理股份公司 2024-06-07 CN disclosed
CN-111936488-B Novel compounds for the treatment of parasitic infections 葛兰素史克知识产权开发有限公司 2023-06-27 CN disclosed
WO-2023030667-A1 PROCESS FOR THE PREPARATION OF CHLOROALKYL SUBSTITUTED CYCLIC AMINES HOVIONE SCIENTIA (IE) 2023-03-09 WO disclosed
EP-3938349-A1 SPECIFICALLY SUBSTITUTED 3-(2-ALKOXY-6-ALKYL-4-PROPINYLPHENYL)-3-PYRROLIN-2-ONES AND THEIR USE AS HERBICIDES Bayer Aktiengesellschaft (DE) 2022-01-19 EP disclosed
EP-3938348-A1 NOVEL 3-(2-BROM-4-ALKYNYL-6-ALKOXYPHENYL)-3-PYRROLIN-2-ONES AND THEIR USE AS HERBICIDES Bayer Aktiengesellschaft (DE) 2022-01-19 EP disclosed
US-20210171601-A1 LEUCINE ZIPPER-BASED COMPOSITIONS AND METHODS OF USE MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2021-06-10 US disclosed
US-5068245-A For treatment of plants BASF AKTIENGESELLSCHAFT (DE) 1991-11-26 US disclosed
EP-0309913-A2 Fungicidal N-substituted 3-aryl-pyrrolidine derivatives BASF Aktiengesellschaft (DE) 1989-04-05 EP disclosed
EP-0309913-A2 Fungicidal N-substituted 3-aryl-pyrrolidine derivatives BASF Aktiengesellschaft (DE) 1989-04-05 EP disclosed
US-4590278-A COTININE, INSECTICIDES PHILIP MORRIS INCORPORATED (US) 1986-05-20 US disclosed
US-4452984-A INSECTICIDES PHILIP MORRIS, INC. (US) 1984-06-05 US disclosed
US-4442292-A LARVICIDES PHILIP MORRIS INCORPORATED (US) 1984-04-10 US disclosed
US-4332945-A DERIVATIVES OF COTININE PHILIP MORRIS, INCORPORATED (US) 1982-06-01 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-20070039644-A1 Dye for dye sensitized photovoltaic cell and dye sensitized photovoltaic cell prepared using the same CD4, ANXA5, QDPR GNAO1 3729/4885GNAI3 2091/4885GNAI1 2265/4885

“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.