SCHEMBL181813

SCHEMBL181813

[CH]1CCN2CCCc3cccc1c32

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 3/20 0.50
HTR2B P41595 1/20 0.45
CES1 P23141 2/20 0.42
ALOX12 P18054 1/20 0.38
HTR1A P08908 2/20 0.38
KMT2A Q03164 2/20 0.35
RAD52 P43351 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
NISCH Q9Y2I1 1/20 0.34
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2A6 P11509 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL2084830 0.84 HTR2C (0.47) HTR2CHTR2BCES1ALOX12HTR1A
SCHEMBL60540 0.80 HTR2C (0.69) HTR2CHTR2BCES1ALOX12HTR1A
Bromide SCHEMBL8863742 0.78 HTR2C (0.67) HTR2CHTR2BCES1ALOX12HTR1A
SCHEMBL4492996 0.77 HTR2C (0.68) HTR2CHTR2BCES1ALOX12HTR1A
SCHEMBL2338214 0.77 HTR2C (0.65) HTR2CHTR2BCES1ALOX12HTR1A
SCHEMBL3333311 0.75 HTR2C (0.46) HTR2CHTR2BCES1ALOX12HTR1A
SCHEMBL22770710 0.73 HTR2C (0.61) HTR2CHTR2BCES1ALOX12HTR1A
SCHEMBL29494128 0.71 HTR2C (0.66) HTR2CHTR2BCES1ALOX12HTR1A
SCHEMBL4507606 0.71 HTR2C (0.66) HTR2CHTR2BCES1ALOX12HTR1A
SCHEMBL11749876 0.70 CES1 (0.53) HTR2CHTR2BCES1ALOX12HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240199882-A1 THIENYL-DIBENZOAZEPINES AND THEIR DERIVATIVES AS DONORS FOR XANTHENE-BASED SHORT-WAVE INFRARED (SWIR) DYES MISSISSIPPI STATE UNIVERSITY (US) 2024-06-20 US claimed
US-20240124714-A1 NEAR INFRARED DYES FOR BIOLOGICAL IMAGING AND OPTOELECTRONIC DEVICES MISSISSIPPI STATE UNIVERSITY (US) 2024-04-18 US claimed
US-20240115564-A1 HTR1F ANTAGONISTS FOR IMPROVEMENT OF BETA CELL SURVIVAL AND FUNCTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-04-11 US claimed
WO-2023065506-A1 MALACHITE GREEN BORONATE AND DERIVATIVE AND USE THEREOF, AND PREPARATION METHOD THEREFOR 深圳先进技术研究院 2023-04-27 WO claimed
WO-2022155152-A1 HTR1F ANTAGONISTS FOR IMPROVEMENT OF BETA CELL SURVIVAL AND FUNCTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-07-21 WO claimed
EP-3041060-B1 IMAGE SENSOR, AND ELECTRONIC DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2021-06-16 EP claimed
EP-3515991-B1 PHOTOCHROMIC MULTIPLE RING-FUSED NAPHTHOPYRANS HAVING EXTREME LONGWAVE ABSORPTION EXTENDING FAR INTO THE VISIBLE WAVELENGTH RANGE RODENSTOCK GMBH (DE) 2020-10-07 EP claimed
US-10647852-B2 Photochromic multiple ring-fused naphthopyrans having extreme longwave absorption extending far into the visible wavelength range RODENSTOCK GMBH (DE) 2020-05-12 US claimed
US-20190284397-A1 PHOTOCHROMIC MULTIPLE RING-FUSED NAPHTHOPYRANS HAVING EXTREME LONGWAVE ABSORPTION EXTENDING FAR INTO THE VISIBLE WAVELENGTH RANGE RODENSTOCK GMBH (DE) 2019-09-19 US claimed
EP-3515991-A1 PHOTOCHROMIC MULTIPLE RING-FUSED NAPHTHOPYRANS HAVING EXTREME LONGWAVE ABSORPTION EXTENDING FAR INTO THE VISIBLE WAVELENGTH RANGE Rodenstock GmbH (DE) 2019-07-31 EP claimed
EP-0290133-A2 Ternary photoinitiator system for addition polymerization MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-11-09 EP claimed
US-4709026-A INTERMEDIATES FOR SULFONE-CONTAINING STYRENE DERIVATIVE SENSITIZERS AND DYES HOECHST AKTIENGESELLSCHAFT (DE) 1987-11-24 US claimed
EP-0235939-A2 Thermal transfer printing ZENECA LIMITED (GB) 1987-09-09 EP claimed
EP-0147257-B1 INFRARED ABSORBING INKS EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1987-07-08 EP claimed
US-4587538-A Record material THE WIGGINS TEAPE GROUP LIMITED (GB) 1986-05-06 US claimed
EP-0147257-A1 Infrared absorbing inks EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1985-07-03 EP claimed
EP-0145225-A2 Record material The Wiggins Teape Group Limited (GB) 1985-06-19 EP claimed
US-4072519-A Photoconductive composition, and element XEROX CORPORATION (US) 1978-02-07 US claimed
US-4002631-A HEAT-SENSITIVE COLOR FORMERS HODOGAYA CHEMICAL CO., LTD. (JA) 1977-01-11 US claimed
US-3936564-A Pressure-sensitive copying paper containing lactone compounds of pyridine-carboxylic acid HODOGAYA CHEMICAL CO., LTD. (JA) 1976-02-03 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20240115564-A1 HTR1F ANTAGONISTS FOR IMPROVEMENT OF BETA CELL SURVIVAL AND FUNCTION HTR1F, HTR1D, HTR1E HTR2C 17/4885HTR2B 12/4885CES1 1044/4885
US-20240124714-A1 NEAR INFRARED DYES FOR BIOLOGICAL IMAGING AND OPTOELECTRONIC DEVICES SIGMAR1, HEATR1, CD209 HTR2C 1329/4885HTR2B 255/4885CES1 2521/4885
US-10647852-B2 Photochromic multiple ring-fused naphthopyrans having extreme longwave absorption extending far into the visible wavelength range IGLV6-57, PUF60, STRA6 HTR2C 3781/4885HTR2B 3949/4885CES1 3698/4885

“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.