SCHEMBL6384285

SCHEMBL6384285

Nc1ccc(CCc2ccccc2)c(C(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.50
MAOA P21397 4/20 0.50
MAPT P10636 4/20 0.49
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 3/20 0.49
MEN1 O00255 2/20 0.49
THRB P10828 2/20 0.49
RECQL P46063 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
MCL1 Q07820 2/20 0.49
KDM4E B2RXH2 2/20 0.49
CYP3A4 P08684 2/20 0.49
USP2 O75604 1/20 0.49
POLB P06746 1/20 0.49
PKM P14618 1/20 0.49
APEX1 P27695 1/20 0.49
BLM P54132 1/20 0.49
TNF P01375 1/20 0.49
HSPD1 P10809 1/20 0.49
CYP2C9 P11712 1/20 0.49

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
SCHEMBL453471 0.87 MAOB (0.50) MAOBMAOAMAPTKMT2AALDH1A1
SCHEMBL6387042 0.83 HSP90AA1 (0.51) MAOBMAOAMAPTKMT2AALDH1A1
SCHEMBL27383637 0.81 TSHR (0.51) MAPTALDH1A1TDP1KDM4EHSD17B10
SCHEMBL27734240 0.81 TSHR (0.44) MAOBMAOAMAPTKMT2AALDH1A1
SCHEMBL13877023 0.81 MAOA (0.61) MAOBMAOAMAPTKMT2AALDH1A1
SCHEMBL29723827 0.80 DAO (0.49) MAPTALDH1A1MCL1ALOX15BCL2A1
SCHEMBL4135386 0.79 MAOA (0.50) MAOBMAOAKMT2AALDH1A1MEN1
SCHEMBL714231 0.78 ALDH1A1 (0.59) MAPTKMT2AALDH1A1MEN1THRB
SCHEMBL29975597 0.78 FOLH1 (0.66) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL166927 0.78 FOLH1 (0.66) MAPTKMT2AALDH1A1MEN1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050209217-A1 3-Mercaptopyrrolidines as farnesyl protein transferase inhibitors BOYLE FRANCIS T 2005-09-22 US disclosed
US-6946468-B1 3-mercaptopyrrolidines as farnesyl protein transferase inhibitors ZENECA LIMITED (GB) 2005-09-20 US disclosed
EP-0923545-A1 3-MERCAPTOPYRROLIDINES AS FARNESYL PROTEIN TRANSFERASE INHIBITORS ZENECA LIMITED (GB) 1999-06-23 EP disclosed
WO-1998007692-A1 3-MERCAPTOPYRROLIDINES AS FARNESYL PROTEIN TRANSFERASE INHIBITORS ZENECA LIMITED (GB) 1998-02-26 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 (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-20050209217-A1 3-Mercaptopyrrolidines as farnesyl protein transferase inhibitors FNTB, FNTA, KRAS MAOB 3016/4885MAOA 3471/4885MAPT 4052/4885

“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.