SCHEMBL19000705

SCHEMBL19000705

CCCc1cnn(-c2ccccc2)c(=O)c1Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.60
▸ SMN1; SMN2 Q16637 6/20 0.60
▸ MAPT P10636 5/20 0.60
▸ ALDH1A1 P00352 5/20 0.60
▸ HTT P42858 3/20 0.60
▸ NPC1 O15118 3/20 0.60
▸ PAX8 Q06710 3/20 0.60
▸ MITF O75030 1/20 0.60
▸ S1PR4 O95977 1/20 0.60
▸ THRB P10828 1/20 0.60
▸ XBP1 P17861 1/20 0.60
▸ S1PR1 P21453 1/20 0.60
▸ KDM4E B2RXH2 1/20 0.59
▸ CYP1A2 P05177 3/20 0.57
▸ CYP2C9 P11712 3/20 0.57
▸ GAA P10253 1/20 0.51
▸ NPSR1 Q6W5P4 5/20 0.48
▸ RXFP1 Q9HBX9 3/20 0.48
▸ PPARG P37231 2/20 0.48
▸ NCOA2 Q15596 2/20 0.48

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
SCHEMBL13219341 0.76 RAB9A (0.56) RAB9ASMN1; SMN2MAPTALDH1A1HTT
SCHEMBL17074602 0.76 RAB9A (0.85) RAB9ASMN1; SMN2MAPTALDH1A1HTT
SCHEMBL1461789 0.76 RAB9A (1.00) RAB9ASMN1; SMN2MAPTALDH1A1HTT
SCHEMBL13219314 0.75 MAPT (0.72) RAB9ASMN1; SMN2MAPTALDH1A1HTT
SCHEMBL1460657 0.75 NPBWR1 (0.60) RAB9ASMN1; SMN2MAPTALDH1A1HTT
SCHEMBL23402338 0.75 USP2 (0.47) RAB9AMAPTALDH1A1GAANPSR1
SCHEMBL19000712 0.75 MAPT (0.52) RAB9ASMN1; SMN2MAPTALDH1A1HTT
SCHEMBL14468578 0.74 NR4A3 (0.51) RAB9ASMN1; SMN2MAPTALDH1A1HTT
Pyrazon SCHEMBL1858918 0.73 RAB9A (0.70) RAB9ASMN1; SMN2MAPTALDH1A1HTT
Pyrazon SCHEMBL53824 0.73 RAB9A (0.70) RAB9ASMN1; SMN2MAPTALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170173008-A1 ANTIMICROBIAL AGENTS AND SCREENING METHODS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-06-22 — — US disclosed
US-20170173008-A1 ANTIMICROBIAL AGENTS AND SCREENING METHODS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-06-22 — — 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 (1 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-20170173008-A1 ANTIMICROBIAL AGENTS AND SCREENING METHODS BAK1, DCLRE1B, BLVRB RAB9A 3085/4885SMN1; SMN2 4088/4885MAPT 4328/4885

“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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