SCHEMBL8958604

SCHEMBL8958604

Cc1c(C)c(C)c(C#N)c(C#N)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.41
ALDH1A1 P00352 7/20 0.37
KDM4E B2RXH2 7/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
MAPT P10636 3/20 0.35
HPGD P15428 4/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
APOBEC3G Q9HC16 3/20 0.33
HTT P42858 2/20 0.33
ALOX15 P16050 2/20 0.33
HSD17B10 Q99714 2/20 0.33
GLA P06280 1/20 0.33
TSHR P16473 1/20 0.33
HAVCR2 Q8TDQ0 1/20 0.32
CYP2A6 P11509 1/20 0.32
GRM6 O15303 1/20 0.31

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
SCHEMBL11445487 0.96 ATM (0.39) ATMALDH1A1KDM4EMEN1KMT2A
SCHEMBL4240428 0.92 ATM (0.41) ATMALDH1A1KDM4EMEN1KMT2A
SCHEMBL31070867 0.92 ATM (0.41) ATMALDH1A1KDM4EMEN1KMT2A
SCHEMBL13389003 0.92 ALDH1A1 (0.37) ATMALDH1A1KDM4EMEN1KMT2A
SCHEMBL13387595 0.89 ALDH1A1 (0.41) ATMALDH1A1KDM4EMEN1KMT2A
SCHEMBL12295133 0.88 ALDH1A1 (0.44) ATMALDH1A1KDM4EMEN1KMT2A
SCHEMBL2154732 0.88 ALDH1A1 (0.39) ATMALDH1A1KDM4EMEN1KMT2A
Water SCHEMBL28241249 0.88 ALDH1A1 (0.39) ATMALDH1A1KDM4EMEN1KMT2A
SCHEMBL16747678 0.85 ALDH1A1 (0.42) ATMALDH1A1KDM4EMEN1KMT2A
SCHEMBL22152362 0.83 ATM (0.33) ATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11807654-B2 Organometallic compound, organic light-emitting device including organometallic compound, and diagnostic composition including organometallic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-11-07 US disclosed
US-10175573-B2 Curable composition and color filter FUJIFILM CORPORATION (JP) 2019-01-08 US disclosed
US-9791606-B2 Optical filter, and solid-state image pickup device and camera module using the optical filter JSR CORPORATION (JP) 2017-10-17 US disclosed
US-9791596-B2 Optical filter, and solid-state image pickup device and camera module using the optical filter JSR CORPORATION (JP) 2017-10-17 US disclosed
US-20170256720-A1 ORGANIC LIGHT-EMITTING DEVICE, AND LIGHT-EMITTING MATERIAL AND COMPOUND USED THEREFOR KYULUX, INC. (JP) 2017-09-07 US disclosed
US-9678257-B2 Photoresist composition for green color filter SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-13 US disclosed
US-9606275-B2 Optical filter, solid-state image pickup device and camera module JSR CORPORATION (JP) 2017-03-28 US disclosed
US-9575213-B2 Optical filter, and solid-state image pickup device and camera module using the optical filter JSR CORPORATION (JP) 2017-02-21 US disclosed
US-20170003417-A1 OPTICAL FILTER, AND SOLID-STATE IMAGE PICKUP DEVICE AND CAMERA MODULE USING THE OPTICAL FILTER JSR CORPORATION (JP) 2017-01-05 US disclosed
US-9502668-B2 Organic light-emitting device, and light-emitting material and compound used therefor KYULUX, INC. (JP) 2016-11-22 US disclosed
US-7704751-B2 Polymeric fluorescent chemical sensor 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-04-27 US disclosed
US-7473777-B2 Method for production of halogen-containing phthalocyanine compound NIPPON SHOKUBAI CO., LTD. (JP) 2009-01-06 US disclosed
US-20080296527-A1 UV CROSS-LINKED POLYMER FUNCTIONALIZED MOLECULAR SIEVE/POLYMER MIXED MATRIX MEMBRANES UOP LLC 2008-12-04 US disclosed
US-20080070320-A1 FLUORESCENT CHEMICAL SENSOR 3M INNOVATIVE PROPERTIES COMPANY 2008-03-20 US disclosed
US-7238801-B2 Phthalocyanine compound, method for production thereof, and near infrared absorbing dye and near infrared absorbing filter using same NIPPON SHOKUBAI CO., LTD. (JP) 2007-07-03 US disclosed
US-5582774-A PHTHALOCYANINE DERIVATIVE MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1996-12-10 US disclosed
US-5446141-A Optical recording media, filters, liquid crystals display MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1995-08-29 US disclosed
EP-0337209-B1 ALKYLPHTHALOCYANINE NEAR-INFRARED ABSORBERS AND RECORDING/DISPLAY MATERIALS USING THE SAME MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-08-04 EP disclosed
US-5024926-A Heat, light, weather resistance; for optical recording media, filters, liquid crystal displays MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1991-06-18 US disclosed
EP-0337209-A2 Alkylphthalocyanine near-infrared absorbers and recording/display materials using the same MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-10-18 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 (2 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-20170256720-A1 ORGANIC LIGHT-EMITTING DEVICE, AND LIGHT-EMITTING MATERIAL AND COMPOUND USED THEREFOR CRY1, WEE1, OR51E2 ATM 3612/4885ALDH1A1 80/4885KDM4E 3233/4885
US-11807654-B2 Organometallic compound, organic light-emitting device including organometallic compound, and diagnostic composition including organometallic compound L1CAM, FOXM1, MEN1 ATM 1865/4885ALDH1A1 385/4885KDM4E 3855/4885

“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.