SCHEMBL19612102

SCHEMBL19612102

O=C(Nc1nc2c(F)cc(F)cc2s1)c1cc(Cl)ccc1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 7/20 0.60
▸ NPC1 O15118 6/20 0.60
▸ MAPT P10636 3/20 0.60
▸ MEN1 O00255 3/20 0.60
▸ KMT2A Q03164 3/20 0.60
▸ LMNA P02545 2/20 0.60
▸ ALDH1A1 P00352 2/20 0.60
▸ AGTR1 P30556 1/20 0.60
▸ OPRK1 P41145 1/20 0.60
▸ HTT P42858 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ P2RX1 P51575 3/20 0.55
▸ P2RX4 Q99571 1/20 0.55
▸ P2RX7 Q99572 1/20 0.55
▸ TAS1R3 Q7RTX0 1/20 0.55
▸ TAS1R1 Q7RTX1 1/20 0.55
▸ TAS1R2 Q8TE23 1/20 0.55
▸ TDP1 Q9NUW8 2/20 0.53
▸ TP53 P04637 1/20 0.53
▸ TNF P01375 1/20 0.52

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
SCHEMBL19627231 0.89 P2RX1 (0.53) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL19612094 0.87 TMPRSS4 (0.52) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL19612110 0.87 TMPRSS4 (0.57) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL17770407 0.86 CASP3 (0.57) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL17770431 0.83 LRRK2 (0.71) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL19612140 0.82 RAB9A (0.55) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL19630790 0.80 RAB9A (0.51) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL19627233 0.80 MAPT (0.58) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL19612095 0.78 TMPRSS4 (0.57) MEN1KMT2AP2RX1P2RX4P2RX7
SCHEMBL19631082 0.78 TMPRSS4 (0.55) MAPTMEN1KMT2AALDH1A1P2RX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3458454-B1 2-HYDROXY-N-(BENZO[D]THIAZOL-2-YL)BENZAMIDE DERIVATIVES AS MITOCHONDRIAL UNCOUPLERS FOR THE TREATMENT OF METABOLIC DISEASES AND CANCER UNIV RUTGERS (US) 2021-11-24 — — EP disclosed
EP-3458454-B1 2-HYDROXY-N-(BENZO[D]THIAZOL-2-YL)BENZAMIDE DERIVATIVES AS MITOCHONDRIAL UNCOUPLERS FOR THE TREATMENT OF METABOLIC DISEASES AND CANCER UNIV RUTGERS (US) 2021-11-24 — — EP disclosed
CN-109415363-B Novel mitochondrial uncoupling agents for the treatment of metabolic diseases and cancer 罗格斯,新泽西州立大学 2021-07-20 — — CN disclosed
EP-3458454-A1 NOVEL MITOCHONDRIAL UNCOUPLERS FOR TREATMENT OF METABOLIC DISEASES AND CANCER Rutgers, The State University of New Jersey (US) 2019-03-27 — — EP disclosed
US-10227315-B2 Mitochondrial uncouplers for treatment of metabolic diseases and cancer RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2019-03-12 — — US disclosed
US-10227315-B2 Mitochondrial uncouplers for treatment of metabolic diseases and cancer RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2019-03-12 — — US disclosed
US-20170334869-A1 NOVEL MITOCHONDRIAL UNCOUPLERS FOR TREATMENT OF METABOLIC DISEASES AND CANCER RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2017-11-23 — — US disclosed
US-20170334869-A1 NOVEL MITOCHONDRIAL UNCOUPLERS FOR TREATMENT OF METABOLIC DISEASES AND CANCER RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2017-11-23 — — US disclosed
US-20170334869-A1 NOVEL MITOCHONDRIAL UNCOUPLERS FOR TREATMENT OF METABOLIC DISEASES AND CANCER RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2017-11-23 — — US disclosed
WO-2017201313-A1 NOVEL MITOCHONDRIAL UNCOUPLERS FOR TREATMENT OF METABOLIC DISEASES AND CANCER JIN SHENGKAN (US) 2017-11-23 — — WO disclosed
WO-2017201313-A1 NOVEL MITOCHONDRIAL UNCOUPLERS FOR TREATMENT OF METABOLIC DISEASES AND CANCER JIN SHENGKAN (US) 2017-11-23 — — 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 (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-10227315-B2 Mitochondrial uncouplers for treatment of metabolic diseases and cancer AK2, PC, GLS2 RAB9A 4289/4885NPC1 719/4885MAPT 2009/4885
US-20170334869-A1 NOVEL MITOCHONDRIAL UNCOUPLERS FOR TREATMENT OF METABOLIC DISEASES AND CANCER AK2, PC, GLS2 RAB9A 4019/4885NPC1 684/4885MAPT 1924/4885

“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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