SCHEMBL21045289

SCHEMBL21045289

O=C(CCCc1ccc(Oc2ccccc2F)cc1)Nc1ccc(O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.67
MAPT P10636 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
MEN1 O00255 1/20 0.67
CYP3A4 P08684 1/20 0.67
TSHR P16473 1/20 0.67
MAPKAPK2 P49137 1/20 0.67
KMT2A Q03164 1/20 0.67
TRPV1 Q8NER1 2/20 0.63
RAB9A P51151 3/20 0.54
LTA4H P09960 2/20 0.51
HDAC1 Q13547 4/20 0.50
HDAC4 P56524 4/20 0.50
HDAC3 O15379 3/20 0.50
HDAC7 Q8WUI4 3/20 0.50
HDAC2 Q92769 3/20 0.50
HDAC10 Q969S8 3/20 0.50
HDAC11 Q96DB2 3/20 0.50
HDAC8 Q9BY41 3/20 0.50
HDAC6 Q9UBN7 3/20 0.50

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
SCHEMBL21045431 0.83 NOTUM (0.59) ALDH1A1SMN1; SMN2MEN1KMT2ATRPV1
SCHEMBL29729259 0.80 ALDH1A1 (1.00) ALDH1A1MAPTSMN1; SMN2MEN1CYP3A4
SCHEMBL169905 0.80 ALDH1A1 (1.00) ALDH1A1MAPTSMN1; SMN2MEN1CYP3A4
SCHEMBL2172082 0.77 HDAC1 (0.61) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL2171203 0.74 HDAC1 (0.71) ALDH1A1MAPTSMN1; SMN2TRPV1RAB9A
SCHEMBL4046853 0.74 PARP10 (0.61) ALDH1A1MEN1KMT2ALTA4HFAAH
SCHEMBL21045307 0.74 MAPT (0.61) ALDH1A1MAPTSMN1; SMN2MEN1CYP3A4
SCHEMBL29411528 0.74 MAPT (0.61) ALDH1A1MAPTSMN1; SMN2MEN1CYP3A4
SCHEMBL20508340 0.73 TRPV1 (0.73) ALDH1A1MAPTSMN1; SMN2MEN1CYP3A4
SCHEMBL2170220 0.73 TRPV1 (0.64) ALDH1A1MAPTSMN1; SMN2TRPV1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250188035-A1 TUBULIN INHIBITORS LIN BIOSCIENCE LLC (US) 2025-06-12 US disclosed
US-12247010-B2 Tubulin inhibitors LIN BIOSCIENCE INC. (TW) 2025-03-11 US disclosed
US-20220089539-A1 TUBULIN INHIBITORS LIN BIOSCIENCE INC. (TW) 2022-03-24 US disclosed
US-20220089539-A1 TUBULIN INHIBITORS LIN BIOSCIENCE INC. (TW) 2022-03-24 US disclosed
US-11040945-B2 Tubulin inhibitors LIN BIOSCIENCE PTY LTD. 2021-06-22 US disclosed
US-11040945-B2 Tubulin inhibitors LIN BIOSCIENCE PTY LTD. 2021-06-22 US disclosed
WO-2019113242-A1 TUBULIN INHIBITORS Lin BioScience, LLC (US) 2019-06-13 WO disclosed
US-20190169127-A1 TUBULIN INHIBITORS LIN BIOSCIENCE INC. (TW) 2019-06-06 US disclosed
US-20190169127-A1 TUBULIN INHIBITORS LIN BIOSCIENCE INC. (TW) 2019-06-06 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 (5 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-20220089539-A1 TUBULIN INHIBITORS TUBB3, TUBB1, TUBB ALDH1A1 3048/4885MAPT 24/4885SMN1; SMN2 1062/4885
US-12247010-B2 Tubulin inhibitors TUBB3, TUBB1, TUBB ALDH1A1 3048/4885MAPT 24/4885SMN1; SMN2 1062/4885
US-11040945-B2 Tubulin inhibitors TUBB3, TUBB1, TUBB ALDH1A1 3048/4885MAPT 24/4885SMN1; SMN2 1062/4885
US-20250188035-A1 TUBULIN INHIBITORS TUBB3, TUBB1, TUBB ALDH1A1 3048/4885MAPT 24/4885SMN1; SMN2 1062/4885
US-20190169127-A1 TUBULIN INHIBITORS TUBB3, TUBB1, TUBB ALDH1A1 3048/4885MAPT 24/4885SMN1; SMN2 1062/4885

“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.