SCHEMBL11912907

SCHEMBL11912907

C#CCCOc1ccc(C=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
MAPT P10636 3/20 0.53
LMNA P02545 3/20 0.53
HPGD P15428 2/20 0.53
CYP2A6 P11509 1/20 0.44
KDM4E B2RXH2 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
RAB9A P51151 1/20 0.41
ALDH1A3 P47895 1/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
STS P08842 1/20 0.39
MAOA P21397 2/20 0.38
MAOB P27338 2/20 0.38
PTGS2 P35354 1/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38

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
SCHEMBL3346351 0.91 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2MAPTLMNAHPGD
Hydrochloric Acid SCHEMBL28530836 0.89 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2MAPTLMNAHPGD
SCHEMBL1232335 0.89 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2MAPTLMNAHPGD
SCHEMBL8926474 0.88 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2MAPTLMNAHPGD
SCHEMBL31725993 0.84 GAA (0.42) MAOAMAOBCA12CA9
SCHEMBL851166 0.82 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2MAPTLMNAHPGD
SCHEMBL20320951 0.81 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2MAPTLMNAHPGD
SCHEMBL825205 0.81 MAOA (0.54) ALDH1A1SMN1; SMN2MAPTLMNAHPGD
SCHEMBL20320950 0.80 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2MAPTLMNAHPGD
SCHEMBL22374404 0.80 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2MAPTLMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11613538-B2 Method of inhibiting or reducing a viral infection PTC THERAPEUTICS, INC. (US) 2023-03-28 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
EP-2434891-B9 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS INC (US) 2021-05-05 EP disclosed
US-20200317668-A1 METHOD OF INHIBITING OR REDUCING A CORONAVIRIDAE VIRUS INFECTION PTC THERAPEUTICS, INC. 2020-10-08 US disclosed
EP-2434891-B1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS INC (US) 2020-07-22 EP disclosed
US-20190194188-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC. 2019-06-27 US disclosed
US-20160340354-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC. 2016-11-24 US disclosed
US-20160340354-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC. 2016-11-24 US disclosed
US-9351964-B2 Methods for treating cancer and non-neoplastic conditions PTC THERAPEUTICS, INC. (US) 2016-05-31 US disclosed
US-9351964-B2 Methods for treating cancer and non-neoplastic conditions PTC THERAPEUTICS, INC. (US) 2016-05-31 US disclosed
US-20120202763-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC (US) 2012-08-09 US disclosed
US-20120202763-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC (US) 2012-08-09 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 (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-20160340354-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA ALDH1A1 3531/4885SMN1; SMN2 3473/4885MAPT 3328/4885
US-20120202763-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA ALDH1A1 3531/4885SMN1; SMN2 3473/4885MAPT 3328/4885
US-20190194188-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA ALDH1A1 3531/4885SMN1; SMN2 3473/4885MAPT 3328/4885
US-20200317668-A1 METHOD OF INHIBITING OR REDUCING A CORONAVIRIDAE VIRUS INFECTION SARS1, POLRMT, EIF2AK2 ALDH1A1 3626/4885SMN1; SMN2 4373/4885MAPT 2964/4885
US-11613538-B2 Method of inhibiting or reducing a viral infection SARS1, EIF2AK2, POLRMT ALDH1A1 3765/4885SMN1; SMN2 4142/4885MAPT 2901/4885

“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.