SCHEMBL69979

SCHEMBL69979

Clc1ccc2ccc(Cl)nc2n1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.34
IDO1 P14902 1/20 0.33
PIK3CD O00329 1/20 0.32
NOS1 P29475 1/20 0.31
DYRK1A Q13627 1/20 0.31
KMT2A Q03164 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
PRMT5 O14744 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
SCHEMBL6412343 0.87 PIK3CD (0.40) SIRT2IDO1PIK3CDNOS1KMT2A
SCHEMBL22337665 0.84 CRHBP (0.30) CRHBPCRHR2
SCHEMBL9849288 0.84 CCR1 (0.44) KMT2A
SCHEMBL30908603 0.79 CCR1 (0.50)
SCHEMBL169736 0.77 ALDH1A1 (0.52) CYP3A4TSHRKMT2ATDP1
SCHEMBL29671296 0.77 ALDH1A1 (0.52) CYP3A4TSHRKMT2ATDP1
SCHEMBL27103126 0.77 KDM4E (0.41) PIK3CD
SCHEMBL28803244 0.76 MAPT (0.36) CYP3A4NOS1TDP1
SCHEMBL207461 0.75 CRHBP (0.32) CRHBPCRHR2
SCHEMBL29533844 0.73 CCR1 (0.43) CRHBPCRHR2CYP3A4TSHRSIRT2

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
CN-114685351-B OLED main body material based on triptycene framework and preparation method and application thereof 中国科学院化学研究所 2023-04-18 CN disclosed
CN-109666158-B Hybrid dynamic polymer and application thereof 厦门逍扬运动科技有限公司 2023-04-07 CN disclosed
CN-114685351-A OLED main body material based on triptycene framework and preparation method and application thereof 中国科学院化学研究所 2022-07-01 CN disclosed
US-10385079-B2 Preparation method for tedizolid, tedizolid intermediate, and preparation method therefor ZHEJIANG HUAHAI PHARMACEUTICAL CO., LTD (CN) 2019-08-20 US disclosed
WO-2017076285-A1 PREPARATION METHOD FOR TEDIZOLID, TEDIZOLID INTERMEDIATE, AND PREPARATION METHOD THEREFOR 浙江华海药业股份有限公司 2017-05-11 WO disclosed
US-8129899-B1 Azafluorene derivative and organic light-emitting device using the derivative CANON KABUSHIKI KAISHA (JP) 2012-03-06 US disclosed
US-20120049176-A1 AZAFLUORENE DERIVATIVE AND ORGANIC LIGHT-EMITTING DEVICE USING THE DERIVATIVE CANON KABUSHIKI KAISHA (JP) 2012-03-01 US disclosed
US-8110685-B2 Efficient, durable electron transport layers; low driving voltage; simple, low cost production CANON KABUSHIKI KAISHA (JP) 2012-02-07 US disclosed
US-7875368-B2 benzoxazole or imidazolopyridine compounds and charge transfer compounds, interposed between a pair of electrodes, to form organic electroluminescent devices, having high emission luminance and efficiency CANON KABUSHIKI KAISHA (JP) 2011-01-25 US disclosed
US-7875368-B2 benzoxazole or imidazolopyridine compounds and charge transfer compounds, interposed between a pair of electrodes, to form organic electroluminescent devices, having high emission luminance and efficiency CANON KABUSHIKI KAISHA (JP) 2011-01-25 US disclosed
US-20060287309-A1 [1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA WARNER-LAMBERT COMPANY LLC 2006-12-21 US disclosed
US-20060287310-A1 [1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA WARNER-LAMBERT COMPANY LLC 2006-12-21 US disclosed
EP-1660497-A1 [ 1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA Warner-Lambert Company LLC (US) 2006-05-31 EP disclosed
EP-1244665-B1 TRIAZATRINAPHTHYRINS AND THE USE THEREOF TRINAPCO INC (US) 2005-08-10 EP disclosed
WO-2005019215-A1 [1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA WARNER-LAMBERT COMPANY LLC (US) 2005-03-03 WO disclosed
US-20050043309-A1 [1,8]naphthyridin-2-ones and related compounds for the treatment of schizophrenia WARNER-LAMBERT COMPANY LLC 2005-02-24 US disclosed
EP-1244665-A1 TRIAZATRINAPHTHYRINS AND THE USE THEREOF Trinapco LLC (US) 2002-10-02 EP disclosed
US-20020077473-A1 TRIAZATRINAPHTHYRINS AND THE USE THEREOF TRINAPCO, INC. 2002-06-20 US disclosed
US-6407089-B1 USEFUL IN EXTRACTION OF TRANSITION METALS, IN PARTICULAR IN THE EXTRACTION OF LANTHANIDES TRINAPCO INC. 2002-06-18 US disclosed
WO-2001046193-A1 TRIAZATRINAPHTHYRINS AND THE USE THEREOF TRINAPCO LLC (US) 2001-06-28 WO 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 (5 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-20050043309-A1 [1,8]naphthyridin-2-ones and related compounds for the treatment of schizophrenia DRD1, DRD2, DRD3 CRHBP 3250/4885CRHR2 983/4885CYP3A4 787/4885
US-10385079-B2 Preparation method for tedizolid, tedizolid intermediate, and preparation method therefor CYP51A1, CYP2F1, CYP4F11 CRHBP 4517/4885CRHR2 4070/4885CYP3A4 27/4885
US-20020077473-A1 TRIAZATRINAPHTHYRINS AND THE USE THEREOF TRRAP, TRHR, LBR CRHBP 549/4885CRHR2 185/4885CYP3A4 2626/4885
US-20060287309-A1 [1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA DRD1, DRD2, DRD3 CRHBP 3250/4885CRHR2 983/4885CYP3A4 787/4885
US-20060287310-A1 [1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA DRD1, DRD2, DRD3 CRHBP 3250/4885CRHR2 983/4885CYP3A4 787/4885

“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.