SCHEMBL17620574

SCHEMBL17620574

Cc1cccn2c1cc1c3ccccc3nc(-c3ccc([N+](=O)[O-])cc3)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.51
▸ MAPT P10636 7/20 0.51
▸ KMT2A Q03164 6/20 0.51
▸ MEN1 O00255 4/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ RAD51 Q06609 1/20 0.48
▸ HTT P42858 3/20 0.45
▸ RXFP1 Q9HBX9 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ PKM P14618 1/20 0.45
▸ POLB P06746 3/20 0.44
▸ CFTR P13569 1/20 0.43
▸ THRB P10828 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ TNKS O95271 1/20 0.41
▸ GUSB P08236 1/20 0.41
▸ NLRP3 Q96P20 1/20 0.41
▸ TNKS2 Q9H2K2 1/20 0.41

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
SCHEMBL17620550 0.85 TDP1 (0.47) ALDH1A1MAPTSMN1; SMN2RAD51KDM4E
SCHEMBL17634370 0.83 MAPT (0.43) ALDH1A1MAPTRAD51KDM4ERAB9A
SCHEMBL17620582 0.82 RAD51 (0.47) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL17634375 0.77 L3MBTL1 (0.43) ALDH1A1MAPTSMN1; SMN2HTTKDM4E
SCHEMBL17620539 0.77 L3MBTL1 (0.52) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL17634380 0.77 ALDH1A1 (0.49) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL17620584 0.77 ADORA2A (0.46) ALDH1A1MAPTKMT2AMEN1RAD51
SCHEMBL17620537 0.77 LMNA (0.42) ALDH1A1MAPTKMT2ARAD51HTT
SCHEMBL17620593 0.75 ADORA2A (0.50) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL18396423 0.75 ACHE (0.38) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10787448-B2 Indolizino [3,2-C] quinoline-based fluorescent probe SEOUL NATIONAL UNIVERSITY R & DB FOUNDATION (KR) 2020-09-29 — — US disclosed
WO-2017014601-A1 INDOLIZINO [3,2-C] QUINOLINE-BASED FLUORESCENT PROBE 서울대학교 산학협력단 2017-01-26 — — WO disclosed
US-20160108042-A1 INDOLIZINO[3,2-c]QUINOLINE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION FOR TREATMENT OF CYSTIC FIBROSIS CONTAINING THE SAME AS ACTIVE INGREDIENT INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2016-04-21 — — US disclosed
US-20160108042-A1 INDOLIZINO[3,2-c]QUINOLINE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION FOR TREATMENT OF CYSTIC FIBROSIS CONTAINING THE SAME AS ACTIVE INGREDIENT INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2016-04-21 — — US disclosed
US-20160108042-A1 INDOLIZINO[3,2-c]QUINOLINE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION FOR TREATMENT OF CYSTIC FIBROSIS CONTAINING THE SAME AS ACTIVE INGREDIENT INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2016-04-21 — — US disclosed
US-9296751-B1 Indolizino[3,2-c]quinoline derivatives, pharmaceutically acceptable salt thereof, preparation method thereof and pharmaceutical composition for treatment of cystic fibrosis containing the same as active ingredient INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2016-03-29 — — US disclosed
US-9296751-B1 Indolizino[3,2-c]quinoline derivatives, pharmaceutically acceptable salt thereof, preparation method thereof and pharmaceutical composition for treatment of cystic fibrosis containing the same as active ingredient INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2016-03-29 — — US disclosed
US-9296751-B1 Indolizino[3,2-c]quinoline derivatives, pharmaceutically acceptable salt thereof, preparation method thereof and pharmaceutical composition for treatment of cystic fibrosis containing the same as active ingredient INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2016-03-29 — — 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 (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-10787448-B2 Indolizino [3,2-C] quinoline-based fluorescent probe DNA2, IRF3, DDB1 ALDH1A1 4405/4885MAPT 1031/4885KMT2A 3767/4885
US-20160108042-A1 INDOLIZINO[3,2-c]QUINOLINE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION FOR TREATMENT OF CYSTIC FIBROSIS CONTAINING THE SAME AS ACTIVE INGREDIENT CFTR, AQP3, AQP1 ALDH1A1 1709/4885MAPT 4884/4885KMT2A 2209/4885

“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.

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