SCHEMBL6480930

SCHEMBL6480930

Cc1cc2ccccc2n1NC(=O)C1CCCCC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.61
▸ MEN1 O00255 3/20 0.61
▸ KMT2A Q03164 3/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.61
▸ KDM4E B2RXH2 1/20 0.61
▸ POLB P06746 1/20 0.61
▸ THRB P10828 1/20 0.61
▸ TSHR P16473 3/20 0.59
▸ CYP2C19 P33261 2/20 0.59
▸ HSD17B10 Q99714 2/20 0.59
▸ CYP1A2 P05177 1/20 0.59
▸ CYP3A4 P08684 1/20 0.59
▸ CYP2D6 P10635 1/20 0.59
▸ ALOX15 P16050 1/20 0.59
▸ CASP1 P29466 1/20 0.59
▸ GAA P10253 1/20 0.53
▸ LMNA P02545 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ RAB9A P51151 2/20 0.44
▸ ADORA1 P30542 2/20 0.44

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
SCHEMBL6480068 0.99 MEN1 (0.60) ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL6480184 0.96 MEN1 (0.57) ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL6482423 0.93 TSHR (0.59) ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL6491958 0.75 MAOA (0.53) ALDH1A1MEN1KMT2AKDM4EHSD17B10
SCHEMBL6188501 0.73 TSHR (0.40) ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL31465692 0.70 MAPT (0.48) ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL31465676 0.69 KDM4E (0.46) ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL31465664 0.69 KDM4E (0.43) ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL31465662 0.69 KDM4E (0.43) ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL6488982 0.69 KMT2A (0.49) ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E

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-20050215614-A1 Substituted indoles and their use as hcv inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2005-09-29 — — US claimed
US-20050215614-A1 Substituted indoles and their use as hcv inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2005-09-29 — — 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 (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-20050215614-A1 Substituted indoles and their use as hcv inhibitors IDO1, IDO2, HAVCR2 ALDH1A1 411/4885MEN1 4842/4885KMT2A 3232/4885

“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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