SCHEMBL18612697

SCHEMBL18612697

CN1CCCc2ccc(C(=O)NO)cc21

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 18/20 0.55
HDAC8 Q9BY41 3/20 0.52
HDAC1 Q13547 11/20 0.51
HDAC3 O15379 2/20 0.49
HDAC2 Q92769 2/20 0.49
TRPV1 Q8NER1 1/20 0.47
ACHE P22303 1/20 0.47
HDAC4 P56524 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46
NCOR2 Q9Y618 1/20 0.46

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
SCHEMBL18612974 0.88 HDAC6 (0.55) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL20119174 0.84 ALDH1A1 (0.56) TRPV1ACHE
SCHEMBL553563 0.82 KDM4E (0.57) TRPV1ACHE
SCHEMBL30219277 0.82 ACHE (0.49) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL21226576 0.77 HDAC6 (0.61) HDAC6HDAC1
SCHEMBL12193492 0.76 ALDH1A1 (0.49) ACHE
SCHEMBL20119292 0.76 RARA (0.51) ACHE
SCHEMBL18581105 0.76 TSHR (0.67) HDAC6HDAC1
SCHEMBL12043752 0.74 MAPT (0.50) HDAC6HDAC1ACHE
SCHEMBL13998316 0.74 TRPV1 (0.64) TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210139439-A1 [6,6] FUSED BICYCLIC HDAC8 INHIBITORS VALO HEALTH, INC. 2021-05-13 US disclosed
US-10829460-B2 [6,6] fused bicyclic HDAC8 inhibitors VALO EARLY DISCOVERY, INC. (US) 2020-11-10 US disclosed
US-20190308946-A1 [6,6] FUSED BICYCLIC HDAC8 INHIBITORS VALO HEALTH, INC. 2019-10-10 US disclosed
US-10370343-B2 [6,6] Fused bicyclic HDAC8 inhibitors FORMA THERAPEUTICS, INC. (US) 2019-08-06 US disclosed
US-10029995-B2 [6,6] fused bicyclic HDAC8 inhibitors FORMA THERAPEUTICS, INC. (US) 2018-07-24 US disclosed
US-20170066729-A1 [6,6] FUSED BICYCLIC HDAC8 INHIBITORS Valo Health, LLC 2017-03-09 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 (6 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-20170066729-A1 [6,6] FUSED BICYCLIC HDAC8 INHIBITORS HDAC8, HDAC3, HDAC2 HDAC6 10/4885HDAC8 1/4885HDAC1 4/4885
US-20210139439-A1 [6,6] FUSED BICYCLIC HDAC8 INHIBITORS HDAC8, HDAC3, HDAC2 HDAC6 10/4885HDAC8 1/4885HDAC1 4/4885
US-10370343-B2 [6,6] Fused bicyclic HDAC8 inhibitors HDAC8, HDAC3, HDAC2 HDAC6 10/4885HDAC8 1/4885HDAC1 4/4885
US-20190308946-A1 [6,6] FUSED BICYCLIC HDAC8 INHIBITORS HDAC8, HDAC3, HDAC2 HDAC6 10/4885HDAC8 1/4885HDAC1 4/4885
US-10829460-B2 [6,6] fused bicyclic HDAC8 inhibitors HDAC8, HDAC1, HDAC2 HDAC6 10/4885HDAC8 1/4885HDAC1 2/4885
US-10029995-B2 [6,6] fused bicyclic HDAC8 inhibitors HDAC8, HDAC3, HDAC2 HDAC6 10/4885HDAC8 1/4885HDAC1 4/4885

“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.